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· · COA & SDS available for every product · Same-day shipping on in-stock items 4-Isopropylcinnamic acid - ≥97% , CAS No.3368-21-6
Synonyms
(E)-3-(4-propan-2-ylphenyl)prop-2-enoic acid | p-Isopropylcinnamic acid | SCHEMBL819055 | AI3-23710 | 2-Propenoic acid, 3-[4-(1-methylethyl)phenyl]-, (2E)- | 2-Propenoic acid, 3-(4-(1-methylethyl)phenyl)- | 3-[4-(propan-2-yl)phenyl]prop-2-enoic acid | F15
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Why this grade ≥97% 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
(E)-3-(4-propan-2-ylphenyl)prop-2-enoic acid | p-Isopropylcinnamic acid | SCHEMBL819055 | AI3-23710 | 2-Propenoic acid, 3-[4-(1-methylethyl)phenyl]-, (2E)- | 2-Propenoic acid, 3-(4-(1-methylethyl)phenyl)- | 3-[4-(propan-2-yl)phenyl]prop-2-enoic acid | F15
Specifications & Purity
≥97%
Names and Identifiers Pubchem Sid 488191232 Pubchem Sid Url https://pubchem.ncbi.nlm.nih.gov/substance/488191232 Canonical Smiles CC(C)C1=CC=C(C=C1)C=CC(=O)O IUPAC Name (E)-3-(4-propan-2-ylphenyl)prop-2-enoic acid InChIKey SJDOOXOUSJDYFE-VMPITWQZSA-N INCHI 1S/C12H14O2/c1-9(2)11-6-3-10(4-7-11)5-8-12(13)14/h3-9H,1-2H3,(H,13,14)/b8-5+ Isomeric SMILES CC(C)C1=CC=C(C=C1)/C=C/C(=O)O Molecular Weight 190.244 Reaxy-Rn 2046679 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2046679&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 acids Intermediate Tree Nodes Not available Direct Parent Cinnamic acids Alternative Parents Monocyclic monoterpenoids Aromatic monoterpenoids Phenylpropanes Cumenes Styrenes Monocarboxylic acids and derivatives Carboxylic acids Organic oxides Hydrocarbon derivatives Carbonyl compounds Molecular Framework Aromatic homomonocyclic compounds Substituents Cinnamic acid - P-cymene - Aromatic monoterpenoid - Monoterpenoid - Monocyclic monoterpenoid - Phenylpropane - Cumene - Styrene - Monocyclic benzene moiety - Benzenoid - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Carbonyl group - Hydrocarbon derivative - Organic oxygen compound - Organooxygen compound - Organic oxide - Aromatic homomonocyclic compound Description This compound belongs to the class of organic compounds known as cinnamic acids. These are organic aromatic compounds containing a benzene and a carboxylic acid group forming 3-phenylprop-2-enoic 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(Human) Associated Targets(non-human) Mechanisms of Action Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Melt Point(°C) 157-161°C Molecular Weight 190.240 g/mol XLogP3 3.300 Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 2 Rotatable Bond Count 3 Exact Mass 190.099 Da Monoisotopic Mass 190.099 Da Topological Polar Surface Area 37.300 Ų Heavy Atom Count 14 Formal Charge 0 Complexity 210.000 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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