M-Toluidine

C₇H₉NCAS 108-44-1107.16 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₇H₉N
Molar mass: 107.16 g/mol
Exact mass: 107.0735 Da
Density: 0.9889 g/mL (at 20 °C)
Melting point: −31.2 °C
Boiling point: 203.3 °C
pKa: 4.69 (conjugate acid, 25 °C)
Flash point: 85 °C (closed cup)
Water solubility: 1 g/L (25 °C)
logP: 1.58Crippen estimate
Polar surface area: 26.0 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 0

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
H400 Very toxic to aquatic lifeHazardous to the aquatic environment, acute hazard

Harmonised EU classification (CLP Annex VI), via PubChem.

Precautionary statements

P260, P261, P262, P264, P270, P271, P273, P280, P301+P316, P302+P352, P304+P340, P316, P319, P321, P330, P361+P364, P391, P403+P233, P405, P501

Identifiers

CAS number

108-44-1

SMILES

Cc1cccc(N)c1

InChIKey

JJYPMNFTHPTTDI-UHFFFAOYSA-N

InChI

InChI=1S/C7H9N/c1-6-3-2-4-7(8)5-6/h2-5H,8H2,1H3

Weigh it out

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

Names and synonyms

13 names · show all

Benzenamine, 3-methyl-
3-Methylbenzenamine
3-Aminotoluene
3-Methylaniline
m-Aminotoluene
3-Toluidine
3-Aminophenylmethane
1-Amino-3-methylbenzene
m-Tolylamine
3-Methylphenylamine
(m-Methylphenyl)amine
m-Methylaniline
NSC 15349

Work with 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

M-Xylene108-38-360 % similar M-Phenylenediamine108-45-260 % similar 3,5-Xylidine108-69-055 % similar m-Phenylenediamine hydrochloride541-69-552 % similar 3,3'-Dimethylbiphenyl612-75-952 % similar 3-Aminobiphenyl2243-47-252 % similar 4-m-Tolylazo-m-toluidine3398-09-249 % similar 3-Chloro-5-methylbenzenamine29027-20-148 % similar

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

Same formula

3-Cyclohexene-1-carbonitrile100-45-8 Benzylamine100-46-9 N-Methylaniline100-61-8 2-Ethylpyridine100-71-0 4-Methylaniline106-49-0 2,4-Lutidine108-47-4 2,6-Lutidine108-48-5 1-Cyclohexene-1-carbonitrile1855-63-6

Elsewhere

PubChem CAS Common Chemistry NIST WebBook