2′-Fluoroacetanilide
Properties
- Molecular formula
- C8H8FNO
- Molar mass
- 153.16 g/mol
- Exact mass
- 153.0590 Da
- Melting point
- 78 °C
- Boiling point
- 141 °C
- logP
- 2.43Crippen estimate
- Polar surface area
- 32.6 Ų
- H-bond donors / acceptors
- 1 / 1
- Rotatable bonds
- 1
Hazards
Warning
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H335 May cause respiratory irritation97.7% of notifiers
Aggregated from 43 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
399-31-5SMILES
CC(O)=Nc1ccccc1FInChIKey
AUZPZBPZWHEIDY-UHFFFAOYSA-NInChI
InChI=1S/C8H8FNO/c1-6(11)10-8-5-3-2-4-7(8)9/h2-5H,1H3,(H,10,11)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
5 names
- Acetamide, N-(2-fluorophenyl)-
- Acetanilide, 2′-fluoro-
- N-(2-Fluorophenyl)acetamide
- o-Fluoroacetanilide
- NSC 51783
Work with 2′-Fluoroacetanilide
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
N-(2,4-Difluorophenyl)acetamide399-36-061 % similar
4'-Chloro-2'-fluoroacetanilide59280-70-559 % similar
N-(2-Methylphenyl)acetamide120-66-158 % similar
N-(2-Bromophenyl)acetamide614-76-658 % similar
2-Acetamidophenol614-80-258 % similar
N-(4-Bromo-2-fluorophenyl)acetamide326-66-957 % similar
N-(2-Chlorophenyl)acetamide533-17-556 % similar
N-[2-(Trifluoromethyl)phenyl]acetamide344-62-756 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.