Cas no 59007-80-6 (3-Methylbenzene-1,2-diamine hydrochloride)

3-Methylbenzene-1,2-diamine hydrochloride structure
59007-80-6 structure
Product Name:3-Methylbenzene-1,2-diamine hydrochloride
CAS No:59007-80-6
MF:C7H11ClN2
MW:158.628640413284
CID:386395
PubChem ID:54610047
Update Time:2025-04-19

3-Methylbenzene-1,2-diamine hydrochloride Chemical and Physical Properties

Names and Identifiers

    • 3-Methylbenzene-1,2-diamine hydrochloride
    • LogP
    • 1,2-Benzenediamine,3-methyl-, hydrochloride (1:2)
    • NSC92747
    • 3-Methylbenzene-1,2-diamine--hydrogen chloride (1/1)
    • 3-methylbenzene-1,2-diamine;hydrochloride
    • DTXSID90974488
    • NSC-92747
    • SB76711
    • 59007-80-6
    • SCHEMBL5033003
    • 1,2-Benzenediamine, 3-methyl-, dihydrochloride
    • Toluylendiamin- Hydrochlorid
    • 3-Methylbenzene-1,2-diaminehydrochloride
    • Inchi: 1S/C7H10N2.ClH/c1-5-3-2-4-6(8)7(5)9;/h2-4H,8-9H2,1H3;1H
    • InChI Key: SIVGRJUBYKXHBH-UHFFFAOYSA-N
    • SMILES: Cl.NC1C(=CC=CC=1C)N

Computed Properties

  • Exact Mass: 194.03796
  • Monoisotopic Mass: 122.084398
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 0
  • Complexity: 92.9
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 52

Experimental Properties

  • Melting Point: 63-64 DEG C
  • Boiling Point: 326°C at 760 mmHg
  • Flash Point: 151°C
  • PSA: 52.04

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