2,3-Diaminotoluene
Properties
- Molecular formula
- C7H10N2
- Molar mass
- 122.17 g/mol
- Exact mass
- 122.0844 Da
- Melting point
- 63–64 °C
- Boiling point
- 255 °C
- logP
- 1.16Crippen estimate
- Polar surface area
- 52.0 Ų
- H-bond donors / acceptors
- 2 / 2
- Rotatable bonds
- 0
Hazards
Danger
- H301 Toxic if swallowed45.5% of notifiers
- H302+H312 Harmful if swallowed or in contact with skin39.4% of notifiers
- H302 Harmful if swallowed54.5% of notifiers
- H311 Toxic in contact with skin20.8% of notifiers
- H312 Harmful in contact with skin79.2% of notifiers
- H315 Causes skin irritation17% of notifiers
- H317 May cause an allergic skin reaction83% of notifiers
- H319 Causes serious eye irritation60.6% of notifiers
- H332 Harmful if inhaled23.5% of notifiers
- H335 May cause respiratory irritation16.7% of notifiers
- H341 Suspected of causing genetic defects74.6% of notifiers
- H350 May cause cancer83% of notifiers
- H361 Suspected of damaging fertility or the unborn child35.2% of notifiers
- H361fd Suspected of damaging fertility; Suspected of damaging the unborn child39.4% of notifiers
- H373 May causes damage to organs through prolonged or repeated exposure74.6% of notifiers
- H411 Toxic to aquatic life with long lasting effects83% of notifiers
Aggregated from 264 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P203, P260, P261, P262, P264, P264+P265, P270, P271, P272, P273, P280, P301+P316, P301+P317, P302+P352, P304+P340, P305+P351+P338, P316, P317, P318, P319, P321, P330, P332+P317, P333+P317, P337+P317, P361+P364, P362+P364, P391, P403+P233, P405, P501
Identifiers
CAS number
2687-25-4SMILES
Cc1cccc(N)c1NInChIKey
AXNUJYHFQHQZBE-UHFFFAOYSA-NInChI
InChI=1S/C7H10N2/c1-5-3-2-4-6(8)7(5)9/h2-4H,8-9H2,1H3Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
12 names
- 1,2-Benzenediamine, 3-methyl-
- Toluene-2,3-diamine
- 3-Methyl-1,2-benzenediamine
- 2,3-Tolylenediamine
- 3-Methyl-o-phenylenediamine
- 3-Methyl-1,2-phenylenediamine
- 1,2-Diamino-3-methylbenzene
- 2,3-Toluylenediamine
- 1-Methyl-2,3-phenylenediamine
- 2-Amino-3-methylaniline
- 3-Methyl-1,2-diaminobenzene
- 2-Methyl-1,6-benzenediamine
Work with 2,3-Diaminotoluene
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
2,6-Xylidine87-62-771 % similar
2,6-Dimethylaniline hydrochloride21436-98-663 % similar
2,3-Xylidine87-59-263 % similar
O-Toluidine95-53-461 % similar
2-Bromo-6-methylaniline53848-17-258 % similar
2-Chloro-6-methylaniline87-63-858 % similar
2-Methoxy-6-methylaniline50868-73-057 % similar
2-Isopropyl-6-methylaniline5266-85-357 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.