N-Ethyl-m-toluidine
Properties
- Molecular formula
- C9H13N
- Molar mass
- 135.21 g/mol
- Exact mass
- 135.1048 Da
- Boiling point
- 221 °C
- logP
- 2.43Crippen estimate
- Polar surface area
- 12.0 Ų
- H-bond donors / acceptors
- 1 / 1
- Rotatable bonds
- 2
Hazards
Danger
- H301+H311+H331 Toxic if swallowed, in contact with skin or if inhaled43.7% of notifiers
- H301 Toxic if swallowed98.9% of notifiers
- H311 Toxic in contact with skin98.9% of notifiers
- H315 Causes skin irritation97.7% of notifiers
- H319 Causes serious eye irritation97.7% of notifiers
- H331 Toxic if inhaled98.9% of notifiers
- H335 May cause respiratory irritation96.6% of notifiers
Aggregated from 87 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P262, P264, P264+P265, P270, P271, P280, P301+P316, P302+P352, P304+P340, P305+P351+P338, P316, P319, P321, P330, P332+P317, P337+P317, P361+P364, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
102-27-2SMILES
CCNc1cccc(C)c1InChIKey
GUYMMHOQXYZMJQ-UHFFFAOYSA-NInChI
InChI=1S/C9H13N/c1-3-10-9-6-4-5-8(2)7-9/h4-7,10H,3H2,1-2H3Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
7 names
- Benzenamine, N-ethyl-3-methyl-
- m-Toluidine, N-ethyl-
- N-Ethyl-3-methylbenzenamine
- N-Ethyl-3-methylaniline
- 3-Methyl-N-ethylaniline
- NSC 8624
- N-Ethyl(3-methylphenyl)amine
Reactions
Work with N-Ethyl-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
N-Ethylaniline103-69-562 % similar
m,m'-Ditolylamine626-13-159 % similar
N-Ethyl-4-methylaniline622-57-157 % similar
3-Methyldiphenylamine1205-64-755 % similar
N,3-Dimethylaniline696-44-655 % similar
3-[(3-Methylphenyl)amino]propanenitrile27618-25-354 % similar
m-Tolylhydrazine hydrochloride637-04-750 % similar
M-Xylene108-38-348 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.