Cas no 155136-55-3 (3-Pyridinecarbonylchloride, 4-(chloromethyl)-)

3-Pyridinecarbonylchloride, 4-(chloromethyl)- structure
155136-55-3 structure
Product Name:3-Pyridinecarbonylchloride, 4-(chloromethyl)-
CAS No:155136-55-3
MF:C7H5Cl2NO
MW:190.026699781418
CID:106864
PubChem ID:10965291
Update Time:2025-04-18

3-Pyridinecarbonylchloride, 4-(chloromethyl)- Chemical and Physical Properties

Names and Identifiers

    • 3-Pyridinecarbonylchloride, 4-(chloromethyl)-
    • 4-(chloromethyl)pyridine-3-carbonyl chloride
    • 3-Pyridinecarbonylchloride,4-(chloromethyl)-(9CI)
    • 155136-55-3
    • 4-chloromethylnicotinoyl chloride
    • DTXSID70450038
    • Inchi: 1S/C7H5Cl2NO/c8-3-5-1-2-10-4-6(5)7(9)11/h1-2,4H,3H2
    • InChI Key: DMRRQFILTAIPIV-UHFFFAOYSA-N
    • SMILES: ClCC1C=CN=CC=1C(=O)Cl

Computed Properties

  • Exact Mass: 188.9748192g/mol
  • Monoisotopic Mass: 188.9748192g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 2
  • Complexity: 151
  • 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: 1.8
  • Topological Polar Surface Area: 30?2
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