Acetovanillin
Properties
- Molecular formula
- C10H10O4
- Molar mass
- 194.19 g/mol
- Exact mass
- 194.0579 Da
- Melting point
- 77 °C
- logP
- 1.43Crippen estimate
- Polar surface area
- 52.6 Ų
- H-bond donors / acceptors
- 0 / 4
- Rotatable bonds
- 3
Hazards
Warning
- H315 Causes skin irritation39.6% of notifiers
- H319 Causes serious eye irritation39.6% of notifiers
Aggregated from 149 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, P362+P364
Identifiers
CAS number
881-68-5SMILES
COc1cc(C=O)ccc1OC(C)=OInChIKey
PZSJOBKRSVRODF-UHFFFAOYSA-NInChI
InChI=1S/C10H10O4/c1-7(12)14-9-4-3-8(6-11)5-10(9)13-2/h3-6H,1-2H3Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
13 names · show all
- Benzaldehyde, 4-(acetyloxy)-3-methoxy-
- Vanillin, acetate
- 4-(Acetyloxy)-3-methoxybenzaldehyde
- 4-Acetoxy-3-methoxybenzaldehyde
- Acetylvanillin
- O-Acetylvanillin
- 4-O-Acetylvanillin
- 4-Formyl-2-methoxyphenol acetate
- 4-Formyl-2-methoxyphenyl acetate
- 4-Acetoxy-5-methoxybenzaldehyde
- NSC 25863
- NSC 8499
- Vanillin acetate
Work with Acetovanillin
Similar compounds
Acetylisoeugenol93-29-872 % similar
4-Acetoxy-3,5-dimethoxybenzaldehyde53669-33-368 % similar
Veratraldehyde120-14-968 % similar
Vanillin isobutyrate20665-85-464 % similar
3-[4-(Acetyloxy)-3-methoxyphenyl]-2-propenoic acid2596-47-664 % similar
2-Methoxyphenyl acetate15212-03-057 % similar
4-Ethoxy-3-methoxybenzaldehyde120-25-256 % similar
4-(Difluoromethoxy)-3-methoxybenzaldehyde162401-70-956 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds