Cas no 136592-25-1 (2-chloro-1-(6-fluoropyridin-3-yl)ethan-1-one)

2-chloro-1-(6-fluoropyridin-3-yl)ethan-1-one structure
136592-25-1 structure
Product Name:2-chloro-1-(6-fluoropyridin-3-yl)ethan-1-one
CAS No:136592-25-1
MF:C7H5ClFNO
MW:173.572104215622
MDL:MFCD28162075
CID:875108
PubChem ID:45080767
Update Time:2025-04-19

2-chloro-1-(6-fluoropyridin-3-yl)ethan-1-one Chemical and Physical Properties

Names and Identifiers

    • Ethanone, 2-chloro-1-(6-fluoro-3-pyridinyl)- (9CI)
    • 2-chloro-1-(6-fluoropyridin-3-yl)ethan-1-one
    • MDL: MFCD28162075
    • Inchi: 1S/C7H5ClFNO/c8-3-6(11)5-1-2-7(9)10-4-5/h1-2,4H,3H2
    • InChI Key: CSKUFRDDRLPBPV-UHFFFAOYSA-N
    • SMILES: ClCC(C1C=NC(=CC=1)F)=O

Computed Properties

  • Exact Mass: 173.00445
  • Monoisotopic Mass: 173.0043696g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 2
  • Complexity: 153
  • 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: 1.6
  • Topological Polar Surface Area: 30?2

Experimental Properties

  • PSA: 29.96

2-chloro-1-(6-fluoropyridin-3-yl)ethan-1-one Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
Enamine
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2-chloro-1-(6-fluoropyridin-3-yl)ethan-1-one
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Enamine
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Enamine
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