3-(Acetyloxy)benzaldehyde
Properties
- Molecular formula
- C9H8O3
- Molar mass
- 164.16 g/mol
- Exact mass
- 164.0473 Da
- Melting point
- 198 °C
- Boiling point
- 140 °C (at 16 Torr)
- logP
- 1.42Crippen estimate
- Polar surface area
- 43.4 Ų
- H-bond donors / acceptors
- 0 / 3
- Rotatable bonds
- 2
Hazards
Warning
- H302 Harmful if swallowed12.5% of notifiers
- H315 Causes skin irritation87.5% of notifiers
- H317 May cause an allergic skin reaction12.5% of notifiers
- H319 Causes serious eye irritation87.5% of notifiers
- H335 May cause respiratory irritation12.5% of notifiers
Aggregated from 8 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P270, P271, P272, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P333+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
34231-78-2SMILES
CC(=O)Oc1cccc(C=O)c1InChIKey
GVUMZPWBUAGJBP-UHFFFAOYSA-NInChI
InChI=1S/C9H8O3/c1-7(11)12-9-4-2-3-8(5-9)6-10/h2-6H,1H3Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
6 names
- Benzaldehyde, 3-(acetyloxy)-
- Benzaldehyde, m-hydroxy-, acetate
- 3-Acetoxybenzaldehyde
- m-Acetoxybenzaldehyde
- m-Hydroxybenzaldehyde acetate
- 3-Formylphenyl acetate
Work with 3-(Acetyloxy)benzaldehyde
Similar compounds
1,3-Dihydroxybenzene diacetate108-58-768 % similar
4-(Acetyloxy)benzaldehyde878-00-265 % similar
3-Methylphenyl acetate122-46-358 % similar
3-Fluorophenyl acetate701-83-758 % similar
3-Methoxybenzaldehyde591-31-157 % similar
Acetylresorcinol102-29-457 % similar
1-[3-(Acetyloxy)phenyl]ethanone2454-35-555 % similar
Phenyl acetate122-79-255 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.