Methyl 4-Hydroxycinnamate

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Catalog Number ACM19367385
Product Name Methyl 4-Hydroxycinnamate
CAS Number 19367-38-5
Structure Methyl 4-Hydroxycinnamate
Description Methyl 4-hydroxycinnamate is a predicted metabolite generated by BioTransformer1 that is produced by the metabolism of methyl 3-phenylprop-2-enoate.
IUPAC Name Methyl (E)-3-(4-hydroxyphenyl)prop-2-enoate
Synonyms (2E)-3-(4-Hydroxyphenyl)-2-propenoic acid methyl ester
Molecular Weight 178.18
Molecular Formula C10H10O3
Canonical SMILES COC(=O)C=CC1=CC=C(C=C1)O
Inchi InChI=1S/C10H10O3/c1-13-10(12)7-4-8-2-5-9(11)6-3-8/h2-7,11H,1H3/b7-4+
InChIKey NITWSHWHQAQBAW-QPJJXVBHSA-N
Boiling Point 306.6±17.0 °C
Melting Point 138-140 °C
Purity 95%+
Solubility Slightly soluble in chloroform and methanol
Physical State Powder

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