Cas no 391669-12-8 (1-Butanone, 4-chloro-1-(5-fluorobenzo[b]thien-3-yl)-)

1-Butanone, 4-chloro-1-(5-fluorobenzo[b]thien-3-yl)- structure
391669-12-8 structure
Product Name:1-Butanone, 4-chloro-1-(5-fluorobenzo[b]thien-3-yl)-
CAS No:391669-12-8
MF:C12H10ClFOS
MW:256.723604679108
CID:1501576
Update Time:2024-08-24

1-Butanone, 4-chloro-1-(5-fluorobenzo[b]thien-3-yl)- Chemical and Physical Properties

Names and Identifiers

    • 1-Butanone, 4-chloro-1-(5-fluorobenzo[b]thien-3-yl)-
    • Inchi: 1S/C12H10ClFOS/c13-5-1-2-11(15)10-7-16-12-4-3-8(14)6-9(10)12/h3-4,6-7H,1-2,5H2
    • InChI Key: ODXYITLNOSDPEW-UHFFFAOYSA-N
    • SMILES: C(C1=CSC2=CC=C(F)C=C21)(=O)CCCCl

Computed Properties

  • Exact Mass: 256.0126

Experimental Properties

  • Density: 1.329±0.06 g/cm3(Predicted)
  • Boiling Point: 394.6±32.0 °C(Predicted)
  • PSA: 17.07
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