Cas no 1204701-64-3 (6-Chloroisoquinolin-3-amine)

6-Chloroisoquinolin-3-amine structure
6-Chloroisoquinolin-3-amine structure
Product Name:6-Chloroisoquinolin-3-amine
CAS No:1204701-64-3
MF:C9H7ClN2
MW:178.618280649185
MDL:MFCD15526544
CID:1082698
PubChem ID:53404481
Update Time:2025-04-20

6-Chloroisoquinolin-3-amine Chemical and Physical Properties

Names and Identifiers

    • 6-chloro-3-Isoquinolinamine
    • 6-chloroisoquinolin-3-amine
    • 1204701-64-3
    • CS-0316613
    • DTXSID40695398
    • SCHEMBL1823506
    • A934418
    • AS-38814
    • AKOS022177600
    • MFCD15526544
    • 6-Chloroisoquinolin-3-amine
    • MDL: MFCD15526544
    • Inchi: 1S/C9H7ClN2/c10-8-2-1-6-5-12-9(11)4-7(6)3-8/h1-5H,(H2,11,12)
    • InChI Key: DNUVOMZZYSNDSU-UHFFFAOYSA-N
    • SMILES: ClC1C=CC2C=NC(=CC=2C=1)N

Computed Properties

  • Exact Mass: 178.0297759g/mol
  • Monoisotopic Mass: 178.0297759g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 0
  • Complexity: 163
  • 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: 2.4
  • Topological Polar Surface Area: 38.9?2

Experimental Properties

  • Density: 1.4±0.1 g/cm3
  • Boiling Point: 365.7±22.0 °C at 760 mmHg
  • Flash Point: 175.0±22.3 °C
  • Vapor Pressure: 0.0±0.8 mmHg at 25°C

6-Chloroisoquinolin-3-amine Security Information

6-Chloroisoquinolin-3-amine Pricemore >>

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