chempirical

m,m'-Ditolylamine

C14H15NCAS 626-13-1197.28 g/mol

Open in Covalent MOL file
HN
Secondary amine

Properties

Molecular formula
C14H15N
Molar mass
197.28 g/mol
Exact mass
197.1204 Da
logP
4.05Crippen estimate
Polar surface area
12.0 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
2

Hazards

Warning
Irritant (GHS07)

Aggregated from 5 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
626-13-1
SMILES
CC1=CC(=CC=C1)NC2=CC=CC(=C2)C
InChIKey
CWVPIIWMONJVGG-UHFFFAOYSA-N
InChI
InChI=1S/C14H15N/c1-11-5-3-7-13(9-11)15-14-8-4-6-12(2)10-14/h3-10,15H,1-2H3

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Names and synonyms

1 names
  • 3,3'-Dimethyldiphenylamine

Work with m,m'-Ditolylamine

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

3-Methyldiphenylamine1205-64-790 % similar N,3-Dimethylaniline696-44-667 % similar M-Xylene108-38-360 % similar N-Ethyl-m-toluidine102-27-259 % similar m-Tolylhydrazine hydrochloride637-04-759 % similar 4-Methyldiphenylamine620-84-858 % similar 3-[(4-Methylphenyl)amino]phenol61537-49-353 % similar 3,3′-Dimethylbiphenyl612-75-952 % similar

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

Same formula

Dibenzylamine103-49-1 2-(Naphthalen-1-yl)pyrrolidine121193-91-7 N-(Diphenylmethyl)methylamine14683-47-7 3,4-Dimethyldiphenylamine17802-36-7 4-(3-Phenylpropyl)pyridine2057-49-0 2-(3-Phenylpropyl)pyridine2110-18-1 2,4-Dimethyldiphenylamine25078-04-0 1,2-Diphenylethylamine25611-78-3

Elsewhere

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