Cas no 1893988-37-8 (3-Chloroquinoxalin-5-amine)

3-Chloroquinoxalin-5-amine structure
3-Chloroquinoxalin-5-amine structure
Product Name:3-Chloroquinoxalin-5-amine
CAS No:1893988-37-8
MF:C8H6ClN3
MW:179.606339931488
CID:5699036
PubChem ID:115015526
Update Time:2023-10-14

3-Chloroquinoxalin-5-amine Chemical and Physical Properties

Names and Identifiers

    • 1893988-37-8
    • 3-Chloroquinoxalin-5-amine
    • Inchi: 1S/C8H6ClN3/c9-7-4-11-6-3-1-2-5(10)8(6)12-7/h1-4H,10H2
    • InChI Key: IFFMKOVSWNZVIG-UHFFFAOYSA-N
    • SMILES: ClC1=CN=C2C=CC=C(C2=N1)N

Computed Properties

  • Exact Mass: 179.0250249g/mol
  • Monoisotopic Mass: 179.0250249g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 0
  • Complexity: 164
  • 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: 2.3
  • Topological Polar Surface Area: 51.8?2
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