Category: 7116-36-1

In 2011,Synthetic Communications included an article by Telvekar, Vikas N.; Patile, Hemlata V.. Computed Properties of C11H13ClO2. The article was titled 《Synthesis of α-azido ketones and esters using recyclable hypervalent iodine reagent》. The information in the text is summarized as follows:

A simple and mild method for the preparation of α-azido ketones and esters using hypervalent iodine reagent, 4,4′-bis(dichloroiodo)biphenyl, and sodium azide in 1,4-dioxane was discussed. Advantages of this system are easy workup, a recyclable reagent, and moderate to good yields. The results came from multiple reactions, including the reaction of Ethyl 3-(4-chlorophenyl)propanoate(cas: 7116-36-1Computed Properties of C11H13ClO2)

Ethyl 3-(4-chlorophenyl)propanoate(cas: 7116-36-1) belongs to organochlorine compounds. The wide structural variety and divergent chemical properties of organochlorides lead to a broad range of names, applications, and properties.Computed Properties of C11H13ClO2 Aliphatic organochlorides are often alkylating agents as chlorine can act as a leaving group, which can result in cellular damage.

Referemce:
Chloride – Wikipedia,
Chlorides – an overview | ScienceDirect Topics

The author of 《Transmission of electronic effects by the cyclopropane ring. Rates of alkaline hydrolysis of ethyl cis- and trans-2-phenylcyclopropanecarboxylates》 were Fuchs, Richard; Bloomfield, Jordan J.. And the article was published in Journal of Organic Chemistry in 1963. Name: Ethyl 3-(4-chlorophenyl)propanoate The author mentioned the following in the article:

The rates of alk. hydrolysis of a series of m- and p-substituted Et β-phenylpropionates and of Et trans- and cis-2-(substituted phenyl)cyclopropanecarboxylates in 7.8% ethanol at 30° were measured. A comparison of Hammett ρ-values for these series, Et cis- and trans-cinnamates, and Et phenylpropiolates indicates that the influence of substituents on the reactivity increases in the six ester series in the order given above. The experimental part of the paper was very detailed, including the reaction process of Ethyl 3-(4-chlorophenyl)propanoate(cas: 7116-36-1Name: Ethyl 3-(4-chlorophenyl)propanoate)

Ethyl 3-(4-chlorophenyl)propanoate(cas: 7116-36-1) belongs to organochlorine compounds. The wide structural variety and divergent chemical properties of organochlorides lead to a broad range of names, applications, and properties.Name: Ethyl 3-(4-chlorophenyl)propanoate Organochlorine compounds have wide use in many applications, though some are of profound environmental concern, with TCDD being one of the most notorious.

Referemce:
Chloride – Wikipedia,
Chlorides – an overview | ScienceDirect Topics

《Substituted 3-phenylpropenoates and related analogs: electron ionization mass spectral fragmentation and density functional theory calculations》 was written by Wheelock, C. E.; Colvin, M. E.; Sanborn, J. R.; Hammock, B. D.. Formula: C11H13ClO2 And the article was included in Journal of Mass Spectrometry on August 31 ,2008. The article conveys some information:

Anal. of Et 3-(2-chlorophenyl)propenoate by electron ionization mass spectrometry showed the distinct loss of an ortho chlorine. To characterize the structural requisites for the observed mass fragmentation, a series of 30 halogen-substituted 3-phenylpropenoate-related structures were examined All ester-containing alkene derivatives exhibited loss of the distinctive chlorine from the 2-position of the Ph ring. Analogous derivatives with the halogen (chlorine or bromine) in the para position did not evidence selective halogen loss. Results demonstrated that substituted 3-phenylpropenoates and their analogs fragment via the formation of a previously reported benzopyrylium intermediate. To understand the correlation between the intramol. radical substitution and the abundance and selectivity of the chlorine (or other halogen) displacement, d. functional theory calculations were performed to determine the charge on the principal cation involved in the chlorine loss (in the ortho, meta, and para positions), the charge for the neutral radical (noncation), the excess alpha-electron d. on the relevant atom and the energy to form the cation from the neutral atom (ionization energy). Results showed that the selectivity and extent of halogen displacement correlated highly to the electrophilicity of the radical cation as well as the neutral radical. These data further support the proposed fragmentation mechanism involving intramol. radical elimination. In the experiment, the researchers used Ethyl 3-(4-chlorophenyl)propanoate(cas: 7116-36-1Formula: C11H13ClO2)

Ethyl 3-(4-chlorophenyl)propanoate(cas: 7116-36-1) belongs to organochlorine compounds. The wide structural variety and divergent chemical properties of organochlorides lead to a broad range of names, applications, and properties.Formula: C11H13ClO2 Organochlorine compounds have wide use in many applications, though some are of profound environmental concern, with TCDD being one of the most notorious.

Referemce:
Chloride – Wikipedia,
Chlorides – an overview | ScienceDirect Topics

Ohtsuka, Yuhki; Uraguchi, Daisuke; Yamamoto, Kyoko; Tokuhisa, Kenji; Yamakawa, Tetsu published an article on January 31 ,2016. The article was titled 《Fenton reagent-catalyzed trifluoromethylation of enamines of 3-oxocarboxylates with CF3I》, and you may find the article in Journal of Fluorine Chemistry.Safety of Ethyl 3-(4-chlorophenyl)propanoate The information in the text is summarized as follows:

The trifluoromethylation of enamines of Et 3-oxocarboxylates catalyzed by Fenton reagent with CF3I was investigated. Trifluoromethylation followed by acid hydrolysis provided 3-oxo-2-(trifluoromethyl)carboxylates in 64-94% yields, which were greater than those obtained by the trifluoromethylation of 3-oxocarboxylates as reported previously. Enamines trifluoromethylated at the 2-position were isolated as intermediates. Hydrolysis and successive decarboxylation of the obtained 3-oxo-2-(trifluoromethyl)carboxylates under acidic conditions provided (2,2,2-trifluoroethyl)ketones in satisfactory yields. The synthesis of the target compounds was achieved using sulfuric acid iron(2+) salt (i.e., iron sulfate) and hydrogen peroxide (H2O2) as Fenton reagent. Starting materials included (iodo)trifluoromethane and enamines, such as 3-amino-2-butenoic acid ester, 3-amino-4-methyl-2-pentenoic acid ester, 3-amino-2-heptenoic acid ester, 3-amino-3-phenyl-2-propenoic acid ester. The title compounds thus formed included 3-oxo-2-(trifluoromethyl)butanoic acid ester, 4-methyl-3-oxo-2-(trifluoromethyl)pentanoic acid ester, β-oxo-α-(trifluoromethyl)benzenepropanoic acid ester. Hydrolysis products included trifluoromethyl ketones, such as 4,4,4-trifluoro-2-butanone, 1,1,1-trifluoro-4-methyl-3-pentanone, 1,1,1-trifluoro-3-heptanone, 3,3,3-trifluoro-1-phenyl-1-propanone. In the part of experimental materials, we found many familiar compounds, such as Ethyl 3-(4-chlorophenyl)propanoate(cas: 7116-36-1Safety of Ethyl 3-(4-chlorophenyl)propanoate)

Ethyl 3-(4-chlorophenyl)propanoate(cas: 7116-36-1) belongs to organochlorine compounds. The wide structural variety and divergent chemical properties of organochlorides lead to a broad range of names, applications, and properties.Safety of Ethyl 3-(4-chlorophenyl)propanoate Aliphatic organochlorides are often alkylating agents as chlorine can act as a leaving group, which can result in cellular damage.

Referemce:
Chloride – Wikipedia,
Chlorides – an overview | ScienceDirect Topics

COA of Formula: C11H13ClO2On May 31, 1988, Uscumlic, G. S.; Krstic, V. V.; Muskatirovic, M. D. published an article in Journal of Molecular Structure. The article was 《Correlation of ultraviolet absorption frequences of cis- and trans-substituted cinnamic acids with Hammett substituent constants》. The article mentions the following:

The UV absorption spectra of cis- and trans-3- and 4-substituted cinnamic acids have been determined Examination of the spectra shows that there is a fair linear relation between the positions of the absorption bands for the electronic transitions of the carbonyl group and the Hammett substituent constants The plot of the λmax values of the cinnamic acids vs. the rate constants for the corresponding acids with diazodiphenylmethane (DDM) in ethanol gave a fair correlations. This relation was discussed in view of the proportionality of the energy of activation for the reaction of these acids with DDM in ethanol and the energy for the electronic transitions in the carbonyl group under the influence of UV radiation. In the experiment, the researchers used many compounds, for example, Ethyl 3-(4-chlorophenyl)propanoate(cas: 7116-36-1COA of Formula: C11H13ClO2)

Ethyl 3-(4-chlorophenyl)propanoate(cas: 7116-36-1) belongs to organochlorine compounds. Alkanes and aryl alkanes may be chlorinated under free radical conditions, with UV light. However, the extent of chlorination is difficult to control. Aryl chlorides may be prepared by the Friedel-Crafts halogenation, using chlorine and a Lewis acid catalyst.COA of Formula: C11H13ClO2

Referemce:
Chloride – Wikipedia,
Chlorides – an overview | ScienceDirect Topics

《Firmness of union of organic radicals and reaction velocity. II. The saponification of esters, addition of hydrogen sulfide to nitroes and the transformation of alkyl chlorides into ethers》 was published in Justus Liebigs Annalen der Chemie in 1927. These research results belong to Kindler, Karl. Electric Literature of C11H13ClO2 The article mentions the following:

cf. C. A. 21, 77. In the saponification of aromatic esters with H2SO4, the following values of k were obtained: m-MeOC6H4CO2Et, 0.0587; 3,4-CH2O2:C6H3CO2Et, 0.0203; Et p-methylmercaptobenzoate, b15 168°, m. 28°, k 0.0388; Et p-ethylbenzoate, b15, 129-30°, 0.0222; p-PhC6H4CO2Et, 0.0536. From these the firmness of union is calculated as follows: Ph, 100; m-MeOC6H4, 83.5; p-PhC6H4, 91.4; p-MeSC6H4, 126; p-EtC6H4, 221; 3,4-CH2O2:C5H3, 241. AcOEt and H2SO4 give a value for k of 0.481; EtCO2Et, 0.226; PrCO2Et, 0.132; BuCO2Et, 0.126; AmCo2Et, 0.131; heptylic acid and caprylic acid also gave values of 0.130; PhCH2CO2Et, 0.636; p-MeOC6H4CH2CO2Et, 0.68O; p-MeC6H4CH2CO2Et, 0-585; p-H2NC6H4CO2Et, 0.325; p-ClC6H4CH2CO2Et, 1.62; p-O2NC6H4CH2CO2Et, 4.57; PhCH2CH2CO2Et, 0.343; p-MeOC6H4CH2CH2CO2Et, b14 165° 0.288; 3,4-CH2O2.C6H3CH2CH2CO2Et, 0.329; p-ClC6H4CH2CO2Et, 0.516; PhCH2CH2CH2CO2Et 0.199; PhCH:CHCO2Et, 0.106; o-MeOC6H4CH:CHCO2Et, 0.0399; p-MeOC6H4CH:CHCO2Et, 0.0444; 3,4-CH2O2:C6H4CH:CHCO2Et, 0.0614; p-MeC6H4CH:CHCO2Et, 0.0754; o-ClC6H4CH:CHCO2Et, 0.211; p-ClC6H4CH:CHCO2Et, 0.215; o-O2NC6H4CH:CHCO2Et, 0.841; m-O2NC6H4CH:CHCO2Et, 0.798; p-O2NC6H4CH:CHCO2Et, 1.037. From these values the relative firmness of union to the group CO2Et is calculated for each of tile above alkyl and aryl groups. The following values of k were obtained for the reaction of nitriles with H2S, the time in min. being given first: PhCH2CN, 345, 0.001105; Ph(CH2)2CN, 240, 0.000499; Ph(CH2)3CN 345, 0.000414; p-ClC6H4CH2CN, 285, 0.002921; EtCN, 1440, O.000158; PrCN, 1440, 0.000094. γ-Phenylthiobutyramide, pale yellow, m. 62° (corrected); p-chlorophenylthioacetamde, egg yolk-yellow, m. 128-9° (corrected); thiobutyramide, red-brown oil. The reaction of alkyl chlorides with EtONa at 31.6° gave the following values for k: PhCH3Cl, 8.70; p-ClC6H4CH2Cl. 15.9; PhCH2-CH2Cl, 0.69; Ph(CH2)3Cl, 0.099. From these values the firmness of union toward Cl is calculated: p-ClC6H4CH2, 54.7; PhCH2, 100; Ph(CH2)2, 1261; Ph(CH2)3, 8778. In the experimental materials used by the author, we found Ethyl 3-(4-chlorophenyl)propanoate(cas: 7116-36-1Electric Literature of C11H13ClO2)

Ethyl 3-(4-chlorophenyl)propanoate(cas: 7116-36-1) belongs to organochlorine compounds. The wide structural variety and divergent chemical properties of organochlorides lead to a broad range of names, applications, and properties.Electric Literature of C11H13ClO2 Organochlorine compounds have wide use in many applications, though some are of profound environmental concern, with TCDD being one of the most notorious.

Referemce:
Chloride – Wikipedia,
Chlorides – an overview | ScienceDirect Topics

Name: Ethyl 3-(4-chlorophenyl)propanoateOn October 31, 2007 ,《Synthesis, biochemical evaluation and rationalisation of the inhibitory activity of a series of 4-substituted phenyl alkyl triazole-based compounds as potential inhibitors of 17α-hydroxylase/17,20-lyase (P45017α)》 appeared in Letters in Drug Design & Discovery. The author of the article were Owen, Caroline P.; Dhanani, Sachin; Patel, Chirag H.; Ahmed, Sabbir. The article conveys some information:

We report the preliminary results into the synthesis and evaluation of triazole-based compounds against the components of 17α-hydroxylase/17,20-lyase (P 45017α), namely 17α-hydroxylase (17α-OHase) and 17,20-lyase (lyase). The results show that the compounds are weaker than ketoconazole but are good lead compounds in the search for inhibitors of P 45017α, in particular, lyase. In the experiment, the researchers used Ethyl 3-(4-chlorophenyl)propanoate(cas: 7116-36-1Name: Ethyl 3-(4-chlorophenyl)propanoate)

Ethyl 3-(4-chlorophenyl)propanoate(cas: 7116-36-1) belongs to organochlorine compounds. Many organochlorine compounds have been isolated from natural sources ranging from bacteria to humans. Name: Ethyl 3-(4-chlorophenyl)propanoate Chlorinated organic compounds are found in nearly every class of biomolecules and natural products including alkaloids, terpenes, amino acids, flavonoids, steroids, and fatty acids.

Referemce:
Chloride – Wikipedia,
Chlorides – an overview | ScienceDirect Topics

Alacid, Emilio; Najera, Carmen published an article in European Journal of Organic Chemistry. The title of the article was 《Acrolein diethyl acetal: a three-carbon homologating reagent for the synthesis of β-arylpropanoates and cinnamaldehydes by Heck reaction catalyzed by a Kaiser oxime resin derived palladacycle》.Electric Literature of C11H13ClO2 The author mentioned the following in the article:

A polymer palladacycle derived from Kaiser oxime resin was used as a source of palladium(0) in the chemoselective Heck reaction of acrolein di-Et acetal with aryl halides under ligand-free conditions. The use of typical Heck conditions afforded 3-arylpropionic esters, and the process can be directed to the synthesis of cinnamaldehydes under Cacchi conditions. These processes take place with rather low loading of the catalyst, which can be recovered by simple filtration and reused for at least five runs without competitive dehalogenation. This is the first time that a supported palladium complex has been reused under Cacchi conditions. ICP-OES analyses of the Pd content of the crude products in both transformations indicated lower leaching for the esters than for the aldehydes in the range up to 0.08 ppm for the esters and 0.8 ppm for the aldehydes. In the experiment, the researchers used Ethyl 3-(4-chlorophenyl)propanoate(cas: 7116-36-1Electric Literature of C11H13ClO2)

Ethyl 3-(4-chlorophenyl)propanoate(cas: 7116-36-1) belongs to organochlorine compounds. Alkanes and aryl alkanes may be chlorinated under free radical conditions, with UV light. Electric Literature of C11H13ClO2 The haloform reaction, using chlorine and sodium hydroxide, is also able to generate alkyl halides from methyl ketones, and related compounds. Chloroform was formerly produced thus.

Referemce:
Chloride – Wikipedia,
Chlorides – an overview | ScienceDirect Topics

Condon, Sylvie; Dupre, Daniel; Falgayrac, Gilles; Nedelec, Jean-Yves published an article on January 31 ,2002. The article was titled 《Nickel-catalyzed electrochemical arylation of activated olefins》, and you may find the article in European Journal of Organic Chemistry.Name: Ethyl 3-(4-chlorophenyl)propanoate The information in the text is summarized as follows:

Ni-catalyzed electrochem. conjugate additions of substituted aryl bromides to activated olefins under recently optimized reaction conditions are reported. Good to high yields were obtained, whatever the nature of substituents in the meta- and para-positions of the benzene ring. In the ortho-substituted series, yields were good with electron-donating substituents, but low with electron-withdrawing groups. The activation of aryl chlorides and the sequential functionalization of aryl dihalides were also studied. In the experimental materials used by the author, we found Ethyl 3-(4-chlorophenyl)propanoate(cas: 7116-36-1Name: Ethyl 3-(4-chlorophenyl)propanoate)

Ethyl 3-(4-chlorophenyl)propanoate(cas: 7116-36-1) belongs to organochlorine compounds. Alkanes and aryl alkanes may be chlorinated under free radical conditions, with UV light. However, the extent of chlorination is difficult to control. Aryl chlorides may be prepared by the Friedel-Crafts halogenation, using chlorine and a Lewis acid catalyst.Name: Ethyl 3-(4-chlorophenyl)propanoate

Referemce:
Chloride – Wikipedia,
Chlorides – an overview | ScienceDirect Topics

Name: Ethyl 3-(4-chlorophenyl)propanoateOn September 30, 2011 ,《Synthesis, antibacterial activities and molecular docking studies of ethyl 3-(4-substituted phenyl) propanoates as targeted antibiotics》 was published in Latin American Journal of Pharmacy. The article was written by Ramaraj, Sivakumar; Vasanthakumari, Pradeepchandran R.; Narasimha, Jayaveera K.; Rajarathnam, Vijaianand; Palani, Kumamallasivan; Panneerselvam, Arulraj; Ramasamy, Venkatnarayanan. The article contains the following contents:

The type II fatty acid synthesis (FAS II) pathway has been recently reported as an attractive target for their efficacy against infections caused by multistrain-resistant Gram-pos. and Gram-neg. bacteria. Among the related FAS II enzymes, beta keto acyl-acyl carrier protein synthase [KAS 3-oxoacyl-[acyl carrier protein] synthase ], is an essential target for novel antibacterial drug design. Several 3-(phenyl)propanoic acid esters (I) were designed, the synthesis of the target compounds was achieved by a multistep process and the products were characterized. I were screened for their inhibitory activity against Escherichia coli β-keto acyl-acyl carrier protein synthase III (ecKAS III) was investigated by mol. docking simulation. I which posses both good inhibitory activity and binding affinity were compared their antibacterial activities against Gram-neg. and Gram-pos. bacterial strains, expecting to discover broad-spectrum antibacterial activity. I displayed significant activity and Et 3-(4-chlorophenyl)propanaoate exhibited the highest antibacterial activity against all tested bacteria. The results came from multiple reactions, including the reaction of Ethyl 3-(4-chlorophenyl)propanoate(cas: 7116-36-1Name: Ethyl 3-(4-chlorophenyl)propanoate)

Ethyl 3-(4-chlorophenyl)propanoate(cas: 7116-36-1) belongs to organochlorine compounds. Alkanes and aryl alkanes may be chlorinated under free radical conditions, with UV light. The haloform reaction, using chlorine and sodium hydroxide, is also able to generate alkyl halides from methyl ketones, and related compounds. Chloroform was formerly produced thus.Name: Ethyl 3-(4-chlorophenyl)propanoate

Referemce:
Chloride – Wikipedia,
Chlorides – an overview | ScienceDirect Topics