Cas no 1060802-07-4 (1-(3-Chloropyridin-2-YL)-2,2,2-trifluoroethanone)

1-(3-Chloropyridin-2-YL)-2,2,2-trifluoroethanone structure
1060802-07-4 structure
Product Name:1-(3-Chloropyridin-2-YL)-2,2,2-trifluoroethanone
CAS No:1060802-07-4
MF:C7H3ClF3NO
MW:209.553031206131
CID:2623914
PubChem ID:72212104
Update Time:2025-04-21

1-(3-Chloropyridin-2-YL)-2,2,2-trifluoroethanone Chemical and Physical Properties

Names and Identifiers

    • 1-(3-CHLOROPYRIDIN-2-YL)-2,2,2-TRIFLUOROETHAN-1-ONE
    • 1060802-07-4
    • AB67614
    • 1-(3-CHLOROPYRIDIN-2-YL)-2,2,2-TRIFLUOROETHANONE
    • 1-(3-Chloropyridin-2-YL)-2,2,2-trifluoroethanone
    • Inchi: 1S/C7H3ClF3NO/c8-4-2-1-3-12-5(4)6(13)7(9,10)11/h1-3H
    • InChI Key: COZKVCRQRZXQLQ-UHFFFAOYSA-N
    • SMILES: ClC1=CC=CN=C1C(C(F)(F)F)=O

Computed Properties

  • Exact Mass: 208.9855259Da
  • Monoisotopic Mass: 208.9855259Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 1
  • Complexity: 206
  • 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: 30?2
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