Cas no 122957-34-0 (Benzonitrile, 4-[(3-amino-4-pyridinyl)amino]-)

Benzonitrile, 4-[(3-amino-4-pyridinyl)amino]- structure
122957-34-0 structure
Product Name:Benzonitrile, 4-[(3-amino-4-pyridinyl)amino]-
CAS No:122957-34-0
MF:C12H10N4
MW:210.23460149765
CID:1214987
PubChem ID:10536420
Update Time:2025-04-20

Benzonitrile, 4-[(3-amino-4-pyridinyl)amino]- Chemical and Physical Properties

Names and Identifiers

    • Benzonitrile, 4-[(3-amino-4-pyridinyl)amino]-
    • 3-amino-4-[N-(4-cyanophenyl)amino]pyridine
    • 4-[(3-amino-4-pyridinyl)amino]Benzonitrile
    • DA-21851
    • SCHEMBL7497750
    • YUSNIYMLRWTCCC-UHFFFAOYSA-N
    • 3-Amino-4-(4'-cyanophenyl)aminopyridine
    • 122957-34-0
    • Inchi: 1S/C12H10N4/c13-7-9-1-3-10(4-2-9)16-12-5-6-15-8-11(12)14/h1-6,8H,14H2,(H,15,16)
    • InChI Key: YUSNIYMLRWTCCC-UHFFFAOYSA-N
    • SMILES: N(C1C=CC(C#N)=CC=1)C1C=CN=CC=1N

Computed Properties

  • Exact Mass: 210.090546336g/mol
  • Monoisotopic Mass: 210.090546336g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 2
  • Complexity: 261
  • 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: 1.4
  • Topological Polar Surface Area: 74.7?2
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