Cas no 128076-64-2 (Ethanone, 1-(2-amino-5-fluorophenyl)-2-chloro- (9CI))

Ethanone, 1-(2-amino-5-fluorophenyl)-2-chloro- (9CI) structure
128076-64-2 structure
Product Name:Ethanone, 1-(2-amino-5-fluorophenyl)-2-chloro- (9CI)
CAS No:128076-64-2
MF:C8H7ClFNO
MW:187.598684549332
CID:1222779
PubChem ID:10750097
Update Time:2025-04-20

Ethanone, 1-(2-amino-5-fluorophenyl)-2-chloro- (9CI) Chemical and Physical Properties

Names and Identifiers

    • Ethanone, 1-(2-amino-5-fluorophenyl)-2-chloro- (9CI)
    • 1-(2-amino-5-fluorophenyl)-2-chloroethanone
    • 2'-amino-2-chloro-5'-fluoroacetophenone
    • DTXSID20444321
    • 128076-64-2
    • Ethanone, 1-(2-amino-5-fluorophenyl)-2-chloro-
    • SCHEMBL5795078
    • 1-(2-Amino-5-fluorophenyl)-2-chloroethan-1-one
    • DB-275970
    • IZAPRVJOMNGPLC-UHFFFAOYSA-N
    • Inchi: 1S/C8H7ClFNO/c9-4-8(12)6-3-5(10)1-2-7(6)11/h1-3H,4,11H2
    • InChI Key: IZAPRVJOMNGPLC-UHFFFAOYSA-N
    • SMILES: ClCC(C1C=C(C=CC=1N)F)=O

Computed Properties

  • Exact Mass: 187.02011
  • Monoisotopic Mass: 187.0200197g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 2
  • Complexity: 176
  • 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: 2.2
  • Topological Polar Surface Area: 43.1?2

Experimental Properties

  • PSA: 43.09

Ethanone, 1-(2-amino-5-fluorophenyl)-2-chloro- (9CI) Related Literature

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