1,2-Diphenylethylamine
Properties
- Molecular formula
- C14H15N
- Molar mass
- 197.28 g/mol
- Exact mass
- 197.1204 Da
- Boiling point
- 311 °C
- logP
- 2.93Crippen estimate
- Polar surface area
- 26.0 Ų
- H-bond donors / acceptors
- 1 / 1
- Rotatable bonds
- 3
Hazards
Warning
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H335 May cause respiratory irritation97.5% of notifiers
Aggregated from 40 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
25611-78-3SMILES
NC(Cc1ccccc1)c1ccccc1InChIKey
DTGGNTMERRTPLR-UHFFFAOYSA-NInChI
InChI=1S/C14H15N/c15-14(13-9-5-2-6-10-13)11-12-7-3-1-4-8-12/h1-10,14H,11,15H2Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
14 names · show all
- Benzeneethanamine, α-phenyl-
- Ethylamine, 1,2-diphenyl-
- α-Phenylbenzeneethanamine
- Ethanamine, 1,2-diphenyl-
- α-Benzylbenzylamine
- 1-Amino-1,2-diphenylethane
- (±)-α-Phenylphenethylamine
- Dl-α-Benzylbenzylamine
- (±)-α,β-Diphenylethylamine
- DL-1,2-Diphenylethylamine
- (±)-1,2-Diphenylethylamine
- 1,2-Diphenethylamine
- 1,2-Diphenylethanamine
- 1,2-Diphenylethan-1-amine
Work with 1,2-Diphenylethylamine
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
1-Phenylpropan-1-amine2941-20-062 % similar
(+)-1-Phenylpropylamine3082-64-262 % similar
(1S)-1-Phenylpropan-1-amine3789-59-162 % similar
2-Amino-2-phenylethan-1-ol20989-17-756 % similar
(R)-Beta-aminophenethyl alcohol56613-80-056 % similar
Phenylglycinol7568-92-556 % similar
γ-Aminobenzenepropanol14593-04-552 % similar
(R)-3-Amino-3-phenylpropan-1-ol170564-98-452 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.