Benzeneacetic acid, 3-hydroxy-4-methoxy-2-(1-oxo-2-propenyl)-, methyl ester structure

Benzeneacetic acid, 3-hydroxy-4-methoxy-2-(1-oxo-2-propenyl)-, methyl ester

methyl 2-(3-hydroxy-4-methoxy-2-prop-2-enoylphenyl)acetate

Also Known As: 3-Hydroxy-4-methoxy-2- benzeneaceticacidmethylester|Methyl (2-acryloyl-3-hydroxy-4-methoxyphenyl)acetate|Methyl (2-acryloyl-3-hydroxy-4-methoxyphenyl)acetate #|Benzeneacetic acid, 3-hydroxy-4-methoxy-2-(1-oxo-2-propenyl)-, methyl ester|methyl 2-(3-hydroxy-4-methoxy-2-prop-2-enoylphenyl)acetate|methyl 2-[3-hydroxy-4-methoxy-2-(prop-2-enoyl)phenyl]acetate|3-Hydroxy-4-methoxy-2-(1-oxo-2-propenyl)benzeneacetic acid methyl ester

CAS: 40992-07-2
Molecular Formula C13H14O5
Molecular Weight 250.08412 g/mol
LogP 2.2
Topological Polar Surface Area 72.8 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 5
Rotatable Bonds 6
Exact Mass 250.08412
Monoisotopic Mass 250.08412
Heavy Atoms 18
Complexity 325.0

Chemical Identifiers

CAS Number 40992-07-2
SMILES COC1=C(C(=C(C=C1)CC(=O)OC)C(=O)C=C)O
InChIKey QDAPOVSCUBDHEH-UHFFFAOYSA-N

Product Overview

Benzeneacetic acid, 3-hydroxy-4-methoxy-2-(1-oxo-2-propenyl)-, methyl ester (CAS 40992-07-2), with molecular formula C13H14O5 and molecular weight 250.08412 g/mol. IUPAC: methyl 2-(3-hydroxy-4-methoxy-2-prop-2-enoylphenyl)acetate.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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