Benzeneacetamide
Properties
- Molecular formula
- C8H9NO
- Molar mass
- 135.17 g/mol
- Exact mass
- 135.0684 Da
- Melting point
- 157 °C
- Boiling point
- 244–279 °C
- logP
- 1.76Crippen estimate
- Polar surface area
- 44.1 Ų
- H-bond donors / acceptors
- 2 / 1
- Rotatable bonds
- 2
Hazards
Warning
- H302 Harmful if swallowed97.7% of notifiers
- H319 Causes serious eye irritation97.7% of notifiers
Aggregated from 44 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P264, P264+P265, P270, P280, P301+P317, P305+P351+P338, P330, P337+P317, P501
Identifiers
CAS number
103-81-1SMILES
N=C(O)Cc1ccccc1InChIKey
LSBDFXRDZJMBSC-UHFFFAOYSA-NInChI
InChI=1S/C8H9NO/c9-8(10)6-7-4-2-1-3-5-7/h1-5H,6H2,(H2,9,10)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
10 names
- Acetamide, 2-phenyl-
- Benzenediacetamide
- 2-Phenylacetamide
- Phenylacetic acid amide
- α-Toluamide
- α-Phenylacetamide
- α-Toluimidic acid
- Phenyl-β-acetylamine
- Phenacetamide
- NSC 1877
Reactions
Work with Benzeneacetamide
Predict the NMR spectrum1H and 13C shifts with multiplicities
Make a solutionWhat to weigh for any molarity and volume
Check drug-likenessLipinski, Veber and lead-likeness
Boiling point under vacuumAt any pressure, from its normal boiling point
Isotope patternExact mass and the mass spectrum pattern
Similar compounds
(4-Hydroxyphenyl)acetamide17194-82-063 % similar
(4-Methoxyphenyl)acetamide6343-93-755 % similar
Phenylacetic acid103-82-250 % similar
Phenoxyacetamide621-88-550 % similar
1-Naphthaleneacetamide86-86-250 % similar
Phenylmethyl N-(2-amino-2-oxoethyl)carbamate949-90-647 % similar
2-[(Diphenylmethyl)thio]acetamide68524-30-147 % similar
Benzylurea538-32-947 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds