Cas no 78754-66-2 (Pyrazine, 3-chloro-2,5-dipropyl-)

Pyrazine, 3-chloro-2,5-dipropyl- structure
78754-66-2 structure
Product Name:Pyrazine, 3-chloro-2,5-dipropyl-
CAS No:78754-66-2
MF:C10H15ClN2
MW:198.692501306534
CID:534017
PubChem ID:12730785
Update Time:2025-04-19

Pyrazine, 3-chloro-2,5-dipropyl- Chemical and Physical Properties

Names and Identifiers

    • Pyrazine, 3-chloro-2,5-dipropyl-
    • 3-chloro-2,5-dipropylpyrazine
    • DTXSID60508330
    • 78754-66-2
    • Inchi: 1S/C10H15ClN2/c1-3-5-8-7-12-9(6-4-2)10(11)13-8/h7H,3-6H2,1-2H3
    • InChI Key: JOCKNJQKXDBRRQ-UHFFFAOYSA-N
    • SMILES: ClC1C(CCC)=NC=C(CCC)N=1

Computed Properties

  • Exact Mass: 198.0923762g/mol
  • Monoisotopic Mass: 198.0923762g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 4
  • Complexity: 141
  • 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: 3.1
  • Topological Polar Surface Area: 25.8?2
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