chempirical

Triphenylamine

C18H15NCAS 603-34-9245.33 g/mol

Open in Covalent MOL file
N
Tertiary amine

Properties

Molecular formula
C18H15N
Molar mass
245.33 g/mol
Exact mass
245.1204 Da
Density
0.774 g/mL (at 0 °C)
Melting point
127 °C
Boiling point
365 °C
Flash point
180 °C (open cup)
Water solubility
< 1 g/L (20 °C)
logP
5.16Crippen estimate
Polar surface area
3.2 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
3

Hazards

Warning
Irritant (GHS07)

Aggregated from 49 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
603-34-9
SMILES
c1ccc(N(c2ccccc2)c2ccccc2)cc1
InChIKey
ODHXBMXNKOYIBV-UHFFFAOYSA-N
InChI
InChI=1S/C18H15N/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18/h1-15H

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Names and synonyms

4 names
  • Benzenamine, N,N-diphenyl-
  • N,N-Diphenylbenzenamine
  • N,N-Diphenylaniline
  • NSC 66458

Reactions

Work with Triphenylamine

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,N,N′,N′-Tetraphenylbenzidine15546-43-775 % similar N-[1,1-Biphenyl]-4-yl-N-phenyl-[1,1-biphenyl]-4-amine122215-84-371 % similar 4-Methyl-N-(4-methylphenyl)-N-phenylbenzenamine20440-95-363 % similar 4,4',4''-Tris(N-3-methylphenyl-N-phenylamino)triphenylamine124729-98-255 % similar Dimethylaniline121-69-750 % similar N,N-Diphenylhydrazine530-50-750 % similar N-Methyl-N-phenylbenzenamine552-82-950 % similar Hexahydro-1,3,5-triphenyl-1,3,5-triazine91-78-150 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

3,4-Diphenylaniline10569-67-2

Elsewhere

PubChem CAS Common Chemistry NIST WebBook Wikipedia