3-[2-(Acetyloxy)phenyl]-2-propenoic acid
Properties
- Molecular formula
- C11H10O4
- Molar mass
- 206.20 g/mol
- Exact mass
- 206.0579 Da
- Melting point
- 152–153 °C
- logP
- 1.71Crippen estimate
- Polar surface area
- 63.6 Ų
- H-bond donors / acceptors
- 1 / 3
- Rotatable bonds
- 3
Hazards
No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library
Identifiers
CAS number
55620-18-3SMILES
CC(=O)Oc1ccccc1C=CC(=O)OInChIKey
UXOWQQCLBQBRMQ-UHFFFAOYSA-NInChI
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)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
7 names
- 2-Propenoic acid, 3-[2-(acetyloxy)phenyl]-
- Cinnamic acid, o-hydroxy-, acetate
- O-Acetyl-o-coumaric acid
- Tylmarin
- NSC 98725
- 2′-Acetoxycinnamic acid
- 2-Acetoxycinnamic acid
Work with 3-[2-(Acetyloxy)phenyl]-2-propenoic acid
Similar compounds
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2-Methoxycinnamic acid6099-03-267 % similar
3-(2-Ethoxyphenyl)-2-propenoic acid69038-81-962 % similar
Acetic acid 2-vinylphenyl ester63600-35-157 % similar
3-[4-(Acetyloxy)-3-methoxyphenyl]-2-propenoic acid2596-47-655 % similar
2-Methylcinnamic acid2373-76-455 % similar
2',3'-Dimethoxycinnamic acid7345-82-655 % similar
3-(2,3-Dimethoxyphenyl)-2-propenoic acid7461-60-155 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds