≥95% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Room temperature Ships Normal Check lot-specific COA for exact specifications.
SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
| Pubchem Sid | 504763781 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/504763781 |
| Canonical Smiles | CC(=O)OC1=CC=CC=C1C=CC(=O)O |
| IUPAC Name | (E)-3-(2-acetyloxyphenyl)prop-2-enoic acid |
| InChIKey | UXOWQQCLBQBRMQ-VOTSOKGWSA-N |
| INCHI | 1S/C11H10O4/c1-8(12)15-10-5-3-2-4-9(10)6-7-11(13)14/h2-7H,1H3,(H,13,14)/b7-6+ |
| Isomeric SMILES | CC(=O)OC1=CC=CC=C1/C=C/C(=O)O |
| RTECS | GD7875000 |
| Molecular Weight | 206.2 |
| Reaxy-Rn | 2694007 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2694007&ln= |
Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS →Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA →Full quality attributes and acceptance criteria for this grade.
View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Phenylpropanoids and polyketides |
| Class | Cinnamic acids and derivatives |
| Subclass | Hydroxycinnamic acids and derivatives |
| Intermediate Tree Nodes | Coumaric acids and derivatives |
| Direct Parent | Coumaric acids |
| Alternative Parents | Cinnamic acids Phenol esters Styrenes Phenoxy compounds Dicarboxylic acids and derivatives Carboxylic acid esters Carboxylic acids Organic oxides Hydrocarbon derivatives Carbonyl compounds |
| Molecular Framework | Aromatic homomonocyclic compounds |
| Substituents | Cinnamic acid - Coumaric acid - Phenol ester - Phenoxy compound - Styrene - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Benzenoid - Carboxylic acid ester - Carboxylic acid - Carboxylic acid derivative - Organic oxide - Organic oxygen compound - Organooxygen compound - Hydrocarbon derivative - Carbonyl group - Aromatic homomonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as coumaric acids. These are aromatic compounds containing a cinnamic acid moiety hydroxylated at the C2 (ortho-), C3 (meta-), or C4 (para-) carbon atom of the benzene ring. |
| External Descriptors | Not available |
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Date | Item |
|---|---|---|---|
 J2313019 | Certificate of Analysis | Sep 28, 2023 | A151300 |
| J2313045 | Certificate of Analysis | Sep 28, 2023 | A151300 |
| J2313046 | Certificate of Analysis | Sep 28, 2023 | A151300 |
| J2313047 | Certificate of Analysis | Sep 28, 2023 | A151300 |
| J2313048 | Certificate of Analysis | Sep 28, 2023 | A151300 |
| J2313049 | Certificate of Analysis | Sep 28, 2023 | A151300 |
| Solubility | Soluble in Methanol |
|---|---|
| Melt Point(°C) | 156 °C |
| Molecular Weight | 206.190 g/mol |
| XLogP3 | 1.600 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 4 |
| Exact Mass | 206.058 Da |
| Monoisotopic Mass | 206.058 Da |
| Topological Polar Surface Area | 63.600 Ų |
| Heavy Atom Count | 15 |
| Formal Charge | 0 |
| Complexity | 270.000 |
| 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 |
