2-Aminobiphenyl
Properties
- Molecular formula
- C12H11N
- Molar mass
- 169.23 g/mol
- Exact mass
- 169.0891 Da
- Melting point
- 51 °C
- Boiling point
- 299 °C
- pKa
- 3.83 (conjugate acid, 18 °C)
- Flash point
- 112.8 °C
- Water solubility
- < 100 mg/L (21.1 °C)
- logP
- 2.94Crippen estimate
- Polar surface area
- 26.0 Ų
- H-bond donors / acceptors
- 1 / 1
- Rotatable bonds
- 1
Hazards
Warning
- H302 Harmful if swallowedAcute toxicity, oral
- H351 Suspected of causing cancerCarcinogenicity
- H412 Harmful to aquatic life with long lasting effectsHazardous to the aquatic environment, long-term hazard
Harmonised EU classification (CLP Annex VI, index 612-142-00-6), via PubChem.
Precautionary statements
P203, P264, P270, P273, P280, P301+P317, P318, P330, P405, P501
Identifiers
CAS number
90-41-5SMILES
Nc1ccccc1-c1ccccc1InChIKey
TWBPWBPGNQWFSJ-UHFFFAOYSA-NInChI
InChI=1S/C12H11N/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9H,13H2Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
12 names
- [1,1′-Biphenyl]-2-amine
- 2-Biphenylamine
- o-Aminodiphenyl
- 2-Aminodiphenyl
- o-Phenylaniline
- o-Biphenylamine
- o-Aminobiphenyl
- 2-Phenylaniline
- 2-Phenylbenzenamine
- NSC 7661
- 2-Amino-1,1′-biphenyl
- 2-Amino-1,1-biphenyl
Work with 2-Aminobiphenyl
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
2-Amino-4'-chlorobiphenyl1204-44-064 % similar
O-Terphenyl84-15-158 % similar
O-Phenylenediamine95-54-553 % similar
3,4,5-Trifluoro-2'-aminobiphenyl915416-45-452 % similar
3'-Trifluoromethylbiphenyl-2-ylamine365-06-052 % similar
2-Bromobiphenyl2052-07-546 % similar
3,4-Diphenylaniline10569-67-244 % similar
2-(Diphenylphosphino)-biphenyl13885-09-144 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.