Cas no 131311-66-5 (1H-Pyrazole-4,5-diamine, 1-(phenylmethyl)-)

1H-Pyrazole-4,5-diamine, 1-(phenylmethyl)- structure
131311-66-5 structure
Product Name:1H-Pyrazole-4,5-diamine, 1-(phenylmethyl)-
CAS No:131311-66-5
MF:C10H12N4
MW:188.22908115387
CID:1228251
PubChem ID:11149648
Update Time:2025-04-20

1H-Pyrazole-4,5-diamine, 1-(phenylmethyl)- Chemical and Physical Properties

Names and Identifiers

    • 1H-Pyrazole-4,5-diamine, 1-(phenylmethyl)-
    • 1-benzyl-4,5-diaminopyrazole
    • 2-benzylpyrazole-3,4-diamine
    • DTXSID70456999
    • AKOS017529965
    • DA-29754
    • 131311-66-5
    • SCHEMBL144813
    • 1-Benzyl-1H-pyrazole-4,5-diamine
    • Inchi: 1S/C10H12N4/c11-9-6-13-14(10(9)12)7-8-4-2-1-3-5-8/h1-6H,7,11-12H2
    • InChI Key: URPJUMVYJFHGOR-UHFFFAOYSA-N
    • SMILES: N1(C(=C(C=N1)N)N)CC1C=CC=CC=1

Computed Properties

  • Exact Mass: 188.106196400g/mol
  • Monoisotopic Mass: 188.106196400g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 2
  • Complexity: 179
  • 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: 0.8
  • Topological Polar Surface Area: 69.9?2
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