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· · COA & SDS available for every product · Same-day shipping on in-stock items Methyl 4-chlorocinnamate - ≥98% , CAS No.7560-44-3
Synonyms
4-Chlorocinnamic Acid Methyl Ester | (E)-methyl3-(4-chlorophenyl)acrylate | 3-(4-Chlorophenyl)-acrylic acid methyl ester | 2-Propenoic acid, 3-(4-chlorophenyl)-, methyl ester | Calcium L-5-methyltetrahydrofolate | ghl.PD_Mitscher_leg0.367 | DTXSID10119468
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Why this grade ≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Room temperature Ships Normal Check lot-specific COA for exact specifications.
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Quality documents SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
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Literature proof Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Specifications Synonyms
4-Chlorocinnamic Acid Methyl Ester | (E)-methyl3-(4-chlorophenyl)acrylate | 3-(4-Chlorophenyl)-acrylic acid methyl ester | 2-Propenoic acid, 3-(4-chlorophenyl)-, methyl ester | Calcium L-5-methyltetrahydrofolate | ghl.PD_Mitscher_leg0.367 | DTXSID10119468
Specifications & Purity
≥98%
Names and Identifiers Pubchem Sid 488195323 Pubchem Sid Url https://pubchem.ncbi.nlm.nih.gov/substance/488195323 Canonical Smiles COC(=O)C=CC1=CC=C(C=C1)Cl IUPAC Name methyl (E)-3-(4-chlorophenyl)prop-2-enoate InChIKey IIBXQGYKZKOORG-QPJJXVBHSA-N INCHI 1S/C10H9ClO2/c1-13-10(12)7-4-8-2-5-9(11)6-3-8/h2-7H,1H3/b7-4+ Isomeric SMILES COC(=O)/C=C/C1=CC=C(C=C1)Cl Molecular Weight 196.64 Reaxy-Rn 1282697 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1282697&ln=
Documentation 📋 Safety Data Sheet (SDS) Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS → ✅ Certificate of Analysis (COA) Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA → 📊 Datasheet Quick-reference summary of product specifications and applications.
View datasheet → 🔬 Specification Sheet Full quality attributes and acceptance criteria for this grade.
View spec sheet →
Advanced Data Taxonomic Classification Kingdom Organic compounds Superclass Phenylpropanoids and polyketides Class Cinnamic acids and derivatives Subclass Cinnamic acid esters Intermediate Tree Nodes Not available Direct Parent Cinnamic acid esters Alternative Parents Styrenes Fatty acid esters Chlorobenzenes Aryl chlorides Methyl esters Enoate esters Monocarboxylic acids and derivatives Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Molecular Framework Aromatic homomonocyclic compounds Substituents Cinnamic acid ester - Styrene - Chlorobenzene - Fatty acid ester - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Fatty acyl - Benzenoid - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Methyl ester - Carboxylic acid ester - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organohalogen compound - Organochloride - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic homomonocyclic compound Description This compound belongs to the class of organic compounds known as cinnamic acid esters. These are compound containing an ester derivative of cinnamic acid. External Descriptors Not available Data sources 1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.
3D Structure Associated Targets(non-human) Mechanisms of Action Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Melt Point(°C) 74-77°C Molecular Weight 196.630 g/mol XLogP3 3.200 Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 2 Rotatable Bond Count 3 Exact Mass 196.029 Da Monoisotopic Mass 196.029 Da Topological Polar Surface Area 26.300 Ų Heavy Atom Count 13 Formal Charge 0 Complexity 193.000 Isotope Atom Count 0 Defined Atom Stereocenter Count 0 Undefined Atom Stereocenter Count 0 Defined Bond Stereocenter Count 1 Undefined Bond Stereocenter Count 0 The total count of all stereochemical bonds 1 Covalently-Bonded Unit Count 1
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