3,4-Diaminotoluene
Properties
- Molecular formula
- C7H10N2
- Molar mass
- 122.17 g/mol
- Exact mass
- 122.0844 Da
- Melting point
- 80–90 °C
- Boiling point
- 265 °C
- logP
- 1.16Crippen estimate
- Polar surface area
- 52.0 Ų
- H-bond donors / acceptors
- 2 / 2
- Rotatable bonds
- 0
Identifiers
CAS number
496-72-0SMILES
Cc1ccc(N)c(N)c1InChIKey
DGRGLKZMKWPMOH-UHFFFAOYSA-NInChI
InChI=1S/C7H10N2/c1-5-2-3-6(8)7(9)4-5/h2-4H,8-9H2,1H3Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
15 names · show all
- 1,2-Benzenediamine, 4-methyl-
- Toluene-3,4-diamine
- 4-Methyl-1,2-benzenediamine
- 4-Methyl-1,2-diaminobenzene
- 4-Methyl-o-phenylenediamine
- 3,4-Diamino-1-methylbenzene
- 3,4-Tolylenediamine
- 4-Methyl-1,2-phenylenediamine
- 1,2-Diamino-4-methylbenzene
- 4-Methyl-2-aminoaniline
- 2-Amino-5-methylaniline
- 2-Amino-4-methylaniline
- NSC 1495
- 5-Methylbenzene-1,2-diamine
- 2-Amino-4-methylphenylamine
Work with 3,4-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
2,4-Xylidine95-68-165 % similar
2,5-Xylidine95-78-365 % similar
2-Chloro-4-methylaniline615-65-663 % similar
2-Iodo-5-methylbenzenamine13194-69-960 % similar
2-Amino-5-methylphenol2835-98-560 % similar
2-Iodo-4-methylaniline29289-13-260 % similar
2-Fluoro-4-methylaniline452-80-260 % similar
2-Fluoro-5-methylaniline452-84-660 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds