Cas no 400876-68-8 (1-(3-Methylphenyl)-1H-pyrazol-4-ylmethylamine)

1-(3-Methylphenyl)-1H-pyrazol-4-ylmethylamine structure
400876-68-8 structure
Product Name:1-(3-Methylphenyl)-1H-pyrazol-4-ylmethylamine
CAS No:400876-68-8
MF:C11H13N3
MW:187.241021871567
CID:874507
PubChem ID:818480
Update Time:2025-07-26

1-(3-Methylphenyl)-1H-pyrazol-4-ylmethylamine Chemical and Physical Properties

Names and Identifiers

    • (1-(m-Tolyl)-1H-pyrazol-4-yl)methanamine
    • [1-(3-Methylphenyl)-1H-pyrazol-4-yl]methylamine
    • 1-(3-METHYLPHENYL)-1H-PYRAZOL-4-YL]METHYLAMINE
    • 1-[1-(3-methylphenyl)-1H-pyrazol-4-yl]methanamine
    • 1-[1-(3-methylphenyl)-1H-pyrazol-4-yl]methanamine(SALTDATA: HCl)
    • STK487787
    • 1-[1-(3-METHYLPHENYL)PYRAZOL-4-YL]METHANAMINE
    • ALBB-003689
    • 400876-68-8
    • SPECS AG-664/25098034
    • [1-(3-methylphenyl)-1H-pyrazol-4-yl]methylamine hydrochloride
    • AG-664/25098034
    • AKOS000181282
    • CS-0316013
    • [1-(3-methylphenyl)pyrazol-4-yl]methanamine
    • CHEMBL4586804
    • DTXSID30355954
    • 1-(3-Methylphenyl)-1H-pyrazol-4-ylmethylamine
    • MDL: MFCD03085815
    • Inchi: 1S/C11H13N3/c1-9-3-2-4-11(5-9)14-8-10(6-12)7-13-14/h2-5,7-8H,6,12H2,1H3
    • InChI Key: OVDUYNRSBLFGDZ-UHFFFAOYSA-N
    • SMILES: N1(C=C(C=N1)CN)C1C=CC=C(C)C=1

Computed Properties

  • Exact Mass: 187.110947427g/mol
  • Monoisotopic Mass: 187.110947427g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 2
  • Complexity: 183
  • 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
  • XLogP3: 1.1
  • Topological Polar Surface Area: 43.8?2

Experimental Properties

  • Density: 1.1±0.1 g/cm3
  • Boiling Point: 337.7±30.0 °C at 760 mmHg
  • Flash Point: 158.0±24.6 °C
  • Vapor Pressure: 0.0±0.7 mmHg at 25°C

1-(3-Methylphenyl)-1H-pyrazol-4-ylmethylamine Security Information

1-(3-Methylphenyl)-1H-pyrazol-4-ylmethylamine Pricemore >>

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