Dimethyl-m-toluidine

C₉H₁₃NCAS 121-72-2135.21 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₉H₁₃N
Molar mass: 135.21 g/mol
Exact mass: 135.1048 Da
Density: 0.94 g/mL
Melting point: 72 °C
Boiling point: 212 °C
logP: 2.06Crippen estimate
Polar surface area: 3.2 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 1

Hazards

Danger

H301 Toxic if swallowedAcute toxicity, oral
H311 Toxic in contact with skinAcute toxicity, dermal
H331 Toxic if inhaledAcute toxicity, inhalation
H373 ** May causes damage to organs through prolonged or repeated exposureSpecific target organ toxicity, repeated exposure
H412 Harmful to aquatic life with long lasting effectsHazardous to the aquatic environment, long-term hazard

Harmonised EU classification (CLP Annex VI, index 612-056-00-9[1]), via PubChem.

Precautionary statements

P260, P261, P262, P264, P270, P271, P273, P280, P301+P316, P302+P352, P304+P340, P316, P319, P321, P330, P361+P364, P403+P233, P405, P501

Identifiers

CAS number

121-72-2

SMILES

Cc1cccc(N(C)C)c1

InChIKey

CWOMTHDOJCARBY-UHFFFAOYSA-N

InChI

InChI=1S/C9H13N/c1-8-5-4-6-9(7-8)10(2)3/h4-7H,1-3H3

Weigh it out

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

Names and synonyms

12 names

Benzenamine, N,N,3-trimethyl-
m-Toluidine, N,N-dimethyl-
N,N,3-Trimethylbenzenamine
N,N-Dimethyl-m-methylaniline
m-Methyl-N,N-dimethylaniline
N,N-Dimethyl-3-methylaniline
m,N,N-Trimethylaniline
N,N,3-Trimethylaniline
3-Methyl-N,N-dimethylaniline
3-(Dimethylamino)toluene
N,N-Dimethyl-m-toluidine
NSC 1788

Work with Dimethyl-m-toluidine

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

4,4',4''-Tris(N-3-methylphenyl-N-phenylamino)triphenylamine124729-98-259 % similar N,N,3,5-Tetramethylaniline4913-13-758 % similar 3-Chloro-N,N-dimethylbenzenamine6848-13-158 % similar Dimethylaniline121-69-757 % similar N,N-Diethyl-m-toluidine91-67-855 % similar M-Xylene108-38-355 % similar 3-Bromo-N,N-dimethylaniline16518-62-054 % similar 3-(Dimethylamino)phenol99-07-054 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

N-Ethyl-m-toluidine102-27-2 3,4-Dimethylbenzenemethanamine102-48-7 Dimethylbenzylamine103-83-3 2,4,5-Trimethylaniline137-17-7 Ethylbenzylamine14321-27-8 (2S)-2-Phenylpropan-1-amine17596-79-1 2-Propylaniline1821-39-2 (αS)-N,α-Dimethylbenzenemethanamine19131-99-8

Elsewhere

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