2,6-Diaminotoluene

C₇H₁₀N₂CAS 823-40-5122.17 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₇H₁₀N₂
Molar mass: 122.17 g/mol
Exact mass: 122.0844 Da
Melting point: 106 °C
Boiling point: 289 °C
Water solubility: soluble
logP: 1.16Crippen estimate
Polar surface area: 52.0 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 0

Hazards

Warning

H302 Harmful if swallowedAcute toxicity, oral
H312 Harmful in contact with skinAcute toxicity, dermal
H317 May cause an allergic skin reactionSensitization, Skin
H341 Suspected of causing genetic defectsGerm cell mutagenicity
H411 Toxic to aquatic life with long lasting effectsHazardous to the aquatic environment, long-term hazard

Harmonised EU classification (CLP Annex VI, index 612-111-00-7), via PubChem.

Precautionary statements

P203, P261, P264, P270, P272, P273, P280, P301+P317, P302+P352, P317, P318, P321, P330, P333+P317, P362+P364, P391, P405, P501

Identifiers

CAS number

823-40-5

SMILES

Cc1c(N)cccc1N

InChIKey

RLYCRLGLCUXUPO-UHFFFAOYSA-N

InChI

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

Weigh it out

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

Names and synonyms

10 names

1,3-Benzenediamine, 2-methyl-
Toluene-2,6-diamine
2-Methyl-1,3-benzenediamine
2,6-Tolylenediamine
2,6-Diamino-1-methylbenzene
2-Methyl-1,3-phenylenediamine
2-Methyl-m-phenylenediamine
2,6-Toluylenediamine
1,3-Diamino-2-methylbenzene
NSC 147490

Work with 2,6-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

2,3-Xylidine87-59-270 % similar 3-Bromo-2-methylaniline55289-36-667 % similar 3-Chloro-2-methylaniline87-60-567 % similar 3-Fluoro-2-methylaniline443-86-764 % similar 2-Amino-o-cresol53222-92-764 % similar 3-Methoxy-2-methylaniline19500-02-861 % similar 2-Methyl-3-(trifluoromethyl)aniline54396-44-058 % similar 3-Amino-2-methylbenzyl alcohol83647-42-156 % 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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