4-Methyltriphenylamine

C₁₉H₁₇NCAS 4316-53-4259.35 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₉H₁₇N
Molar mass: 259.35 g/mol
Exact mass: 259.1361 Da
logP: 5.46Crippen estimate
Polar surface area: 3.2 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 3

Hazards

Warning

H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers

Aggregated from the ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, P362+P364

Identifiers

CAS number

4316-53-4

SMILES

CC1=CC=C(C=C1)N(C2=CC=CC=C2)C3=CC=CC=C3

InChIKey

IULUNTXBHHKFFR-UHFFFAOYSA-N

InChI

InChI=1S/C19H17N/c1-16-12-14-19(15-13-16)20(17-8-4-2-5-9-17)18-10-6-3-7-11-18/h2-15H,1H3

Weigh it out

Type any one amount. The others follow from the molar mass.

Work with 4-Methyltriphenylamine

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 Isotope patternExact mass and the mass spectrum pattern

Similar compounds

4-Methyl-N-(4-methylphenyl)-N-phenylbenzenamine20440-95-3100 % similar N,N'-Diphenyl-N,N'-di-P-tolyl- benzidine20441-06-986 % similar Tri-p-tolylamine1159-53-179 % similar 4,4',4''-Tris(N-3-methylphenyl-N-phenylamino)triphenylamine124729-98-271 % similar N,N,N′,N′-Tetra(4-methylphenyl)-1,1′-biphenyl-4,4′-diamine76185-65-468 % similar Triphenylamine603-34-963 % similar N,N′-Diphenyl-N,N-bis(3-methylphenyl)-1,1′-biphenyl-4,4′-diamine65181-78-463 % similar 4-Bis(4-methylphenyl)aminobenzaldehyde-1,1-diphenyl-hydrazone83992-95-461 % similar

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

Same formula

Tritylamine5824-40-8

Elsewhere

PubChem CAS Common Chemistry NIST WebBook