Cas no 1211517-62-2 (Isoquinoline-1-sulfonyl chloride)

Isoquinoline-1-sulfonyl chloride structure
1211517-62-2 structure
Product Name:Isoquinoline-1-sulfonyl chloride
CAS No:1211517-62-2
MF:C9H6ClNO2S
MW:227.667439937592
MDL:MFCD18261879
CID:4563092
PubChem ID:19796337
Update Time:2024-03-01

Isoquinoline-1-sulfonyl chloride Chemical and Physical Properties

Names and Identifiers

    • isoquinoline-1-sulfonyl chloride
    • 1-Isoquinolinesulfonyl chloride
    • isoquinoline sulfonylchloride
    • A934028
    • Isoquinoline-1-sulfonyl chloride
    • MDL: MFCD18261879
    • Inchi: 1S/C9H6ClNO2S/c10-14(12,13)9-8-4-2-1-3-7(8)5-6-11-9/h1-6H
    • InChI Key: MIGRFORREVIOBF-UHFFFAOYSA-N
    • SMILES: ClS(C1C2C=CC=CC=2C=CN=1)(=O)=O

Computed Properties

  • Exact Mass: 226.9807773g/mol
  • Monoisotopic Mass: 226.9807773g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 1
  • Complexity: 298
  • 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: 2.6
  • Topological Polar Surface Area: 55.4

Isoquinoline-1-sulfonyl chloride Pricemore >>

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