2-(Acetyloxy)benzonitrile
Properties
- Molecular formula
- C9H7NO2
- Molar mass
- 161.16 g/mol
- Exact mass
- 161.0477 Da
- logP
- 1.48Crippen estimate
- Polar surface area
- 50.1 Ų
- H-bond donors / acceptors
- 0 / 3
- Rotatable bonds
- 1
Hazards
Warning
- H302 Harmful if swallowed100% of notifiers
- H312 Harmful in contact with skin100% of notifiers
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H332 Harmful if inhaled100% of notifiers
Aggregated from the ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P321, P330, P332+P317, P337+P317, P362+P364, P501
Identifiers
CAS number
5715-02-6SMILES
CC(=O)Oc1ccccc1C#NInChIKey
XXLKCUTUGWSJJO-UHFFFAOYSA-NInChI
InChI=1S/C9H7NO2/c1-7(11)12-9-5-3-2-4-8(9)6-10/h2-5H,1H3Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
6 names
- Benzonitrile, 2-(acetyloxy)-
- Salicylonitrile, acetate
- Acetylsalicylonitrile
- 2-Cyanophenyl acetate
- 2-Acetoxybenzonitrile
- o-Acetoxybenzonitrile
Work with 2-(Acetyloxy)benzonitrile
Similar compounds
Pyrogallol triacetate525-52-059 % similar
2-Methoxyphenyl acetate15212-03-056 % similar
2-Methylphenyl acetate533-18-656 % similar
2-Chlorophenyl acetate4525-75-154 % similar
Acetic acid 2-vinylphenyl ester63600-35-154 % similar
1-Naphthyl acetate830-81-953 % similar
2-Methoxybenzonitrile6609-56-952 % similar
Aspirin50-78-250 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.