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· · COA & SDS available for every product · Same-day shipping on in-stock items Methyl 4-hydroxycinnamate - Moligand™, ≥98% , CAS No.3943-97-3
GRADE & PURITY Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥98% Synonyms
Cinnamic acid, p-hydroxy-, methyl ester (8CI) | Methyl Trans-P-Coumaric Acid | AG-690/03019022 | CHEBI:86904 | Methyl (E)-4-hydroxycinnamate | CHEBI:194094 | E-3-(4-hydroxyphenyl)acrylic acid methyl ester | E-3-(4-hydroxy-phenyl)-acrylic acid methyl ester
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Why this grade Moligand™, ≥98% Moligand™ 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 5 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Specifications Synonyms
Cinnamic acid, p-hydroxy-, methyl ester (8CI) | Methyl Trans-P-Coumaric Acid | AG-690/03019022 | CHEBI:86904 | Methyl (E)-4-hydroxycinnamate | CHEBI:194094 | E-3-(4-hydroxyphenyl)acrylic acid methyl ester | E-3-(4-hydroxy-phenyl)-acrylic acid methyl ester
Specifications & Purity
Moligand™, ≥98%
Names and Identifiers Pubchem Sid 508809741 Pubchem Sid Url https://pubchem.ncbi.nlm.nih.gov/substance/508809741 Canonical Smiles COC(=O)C=CC1=CC=C(C=C1)O IUPAC Name methyl (E)-3-(4-hydroxyphenyl)prop-2-enoate InChIKey NITWSHWHQAQBAW-QPJJXVBHSA-N INCHI 1S/C10H10O3/c1-13-10(12)7-4-8-2-5-9(11)6-3-8/h2-7,11H,1H3/b7-4+ Isomeric SMILES COC(=O)/C=C/C1=CC=C(C=C1)O Molecular Weight 178.2 Reaxy-Rn 2208400 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2208400&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 Hydroxycinnamic acids and derivatives Intermediate Tree Nodes Hydroxycinnamic acid esters Direct Parent Coumaric acid esters Alternative Parents Coumaric acids and derivatives Cinnamic acid esters Styrenes Fatty acid esters 1-hydroxy-2-unsubstituted benzenoids Methyl esters Enoate esters Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Carbonyl compounds Molecular Framework Aromatic homomonocyclic compounds Substituents Coumaric acid ester - Coumaric acid or derivatives - Cinnamic acid ester - Styrene - Phenol - Fatty acid ester - 1-hydroxy-2-unsubstituted benzenoid - Fatty acyl - Benzenoid - Monocyclic benzene moiety - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Methyl ester - Carboxylic acid ester - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Organic oxygen compound - Organooxygen compound - Carbonyl group - Organic oxide - Aromatic homomonocyclic compound Description This compound belongs to the class of organic compounds known as coumaric acid esters. These are aromatic compounds containing an ester derivative of coumaric acid. External Descriptors cinnamate ester 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(Human) Associated Targets(non-human) Mechanisms of Action Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Molecular Weight 178.180 g/mol XLogP3 2.300 Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 3 Rotatable Bond Count 3 Exact Mass 178.063 Da Monoisotopic Mass 178.063 Da Topological Polar Surface Area 46.500 Ų Heavy Atom Count 13 Formal Charge 0 Complexity 190.000 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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Reconstitution Calculator Reviews Need help choosing the grade? Our grade selection guide covers purity, stabilizer status, and application suitability for all variants in our catalog.
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