chempirical

2,4-Dimethyldiphenylamine

C14H15NCAS 25078-04-0197.28 g/mol

Open in Covalent MOL file
NH
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 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
25078-04-0
SMILES
CC1=CC(=C(C=C1)NC2=CC=CC=C2)C
InChIKey
BWYYRZBQXLCZJL-UHFFFAOYSA-N
InChI
InChI=1S/C14H15N/c1-11-8-9-14(12(2)10-11)15-13-6-4-3-5-7-13/h3-10,15H,1-2H3

Weigh it out

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Work with 2,4-Dimethyldiphenylamine

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

N-(2,4-Dimethylphenyl)-2,4-dimethylbenzenamine19616-28-570 % similar 4-Methoxy-2-methyl-N-phenylbenzenamine41317-15-160 % similar 3-Methyldiphenylamine1205-64-757 % similar 4-Methyldiphenylamine620-84-855 % similar 2,4-Dimethylphenylhydrazine hydrochloride60480-83-350 % similar m,m'-Ditolylamine626-13-150 % similar 1,2,4-Trimethylbenzene95-63-645 % similar N-(2,4-Dimethylphenyl)thiourea16738-20-845 % 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 1,2-Diphenylethylamine25611-78-3 2,2-Diphenylethylamine3963-62-0

Elsewhere

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