Cas no 501901-96-8 (Ethanone, 1-(5-bromo-2-methylbenzo[b]thien-3-yl)-)

Ethanone, 1-(5-bromo-2-methylbenzo[b]thien-3-yl)- structure
501901-96-8 structure
Product Name:Ethanone, 1-(5-bromo-2-methylbenzo[b]thien-3-yl)-
CAS No:501901-96-8
MF:C11H9BrOS
MW:269.157561063766
CID:1566710
Update Time:2024-08-24

Ethanone, 1-(5-bromo-2-methylbenzo[b]thien-3-yl)- Chemical and Physical Properties

Names and Identifiers

    • Ethanone, 1-(5-bromo-2-methylbenzo[b]thien-3-yl)-
    • Inchi: 1S/C11H9BrOS/c1-6(13)11-7(2)14-10-4-3-8(12)5-9(10)11/h3-5H,1-2H3
    • InChI Key: HUYKYOJXRJQVDQ-UHFFFAOYSA-N
    • SMILES: C(=O)(C1=C(C)SC2=CC=C(Br)C=C21)C

Computed Properties

  • Exact Mass: 267.95577

Experimental Properties

  • Density: 1.520±0.06 g/cm3(Predicted)
  • Melting Point: 94-96 °C(Solv: hexane (110-54-3))
  • Boiling Point: 372.3±37.0 °C(Predicted)
  • PSA: 17.07
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