4-Amino-N-methylaniline

C₇H₁₀N₂CAS 623-09-6122.17 g/mol

Open in Covalent MOL file

Primary amine Secondary amine

Properties

Molecular formula: C₇H₁₀N₂
Molar mass: 122.17 g/mol
Exact mass: 122.0844 Da
Melting point: 36 °C
Boiling point: 258 °C
logP: 1.31Crippen estimate
Polar surface area: 38.0 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 1

Hazards

Warning

H302 Harmful if swallowed100% of notifiers
H312 Harmful in contact with skin100% of notifiers
H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H332 Harmful if inhaled100% of notifiers
H335 May cause respiratory irritation100% of notifiers

Aggregated from 2 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, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

623-09-6

SMILES

CNc1ccc(N)cc1

InChIKey

VVYWUQOTMZEJRJ-UHFFFAOYSA-N

InChI

InChI=1S/C7H10N2/c1-9-7-4-2-6(8)3-5-7/h2-5,9H,8H2,1H3

Weigh it out

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

Names and synonyms

10 names

N-Methyl-P-phenylenediamine
1,4-Benzenediamine, N1-methyl-
p-Phenylenediamine, N-methyl-
1,4-Benzenediamine, N-methyl-
N1-Methyl-1,4-benzenediamine
p-(Methylamino)aniline
N-Methyl-1,4-phenylenediamine
4-(Methylamino)aniline
N-Methylbenzene-1,4-diamine
1-N-Methylbenzene-1,4-diamine

Work with 4-Amino-N-methylaniline

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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

N-Methyl-p-phenylenediamine dihydrochloride5395-70-0Salt

Similar compounds

N-Methyl-p-toluidine623-08-552 % similar N-Methylaniline100-61-850 % similar P-Phenylenediamine106-50-350 % similar N-Methyl-p-aminophenol150-75-450 % similar 4-Fluoro-N-methylaniline459-59-650 % similar 4-Bromo-N-methylaniline6911-87-150 % similar 4-Chloro-N-methylbenzenamine932-96-750 % similar 4-Aminodiphenylamine101-54-248 % similar

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

Same formula

2,4-Dimethylpyridin-3-amine1073-21-8 4-Dimethylaminopyridine1122-58-3 4,6-Dimethyl-3-pyridinamine1193-71-1 4-Pyridineethanamine13258-63-4 2-Ethyl-5-methylpyrazine13360-64-0 2,3,5-Trimethylpyrazine14667-55-1 3-Methyl-2-pyridinemethanamine153936-26-6 2-Ethyl-3-methylpyrazine15707-23-0

Elsewhere

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