Cas no 34586-87-3 (Benzo[b]thiophene-2-carboxamide, 3-chloro-6-methyl-)

Benzo[b]thiophene-2-carboxamide, 3-chloro-6-methyl- structure
34586-87-3 structure
Product Name:Benzo[b]thiophene-2-carboxamide, 3-chloro-6-methyl-
CAS No:34586-87-3
MF:C10H8ClNOS
MW:225.694620132446
MDL:MFCD01923404
CID:1469253
PubChem ID:874724
Update Time:2025-09-21

Benzo[b]thiophene-2-carboxamide, 3-chloro-6-methyl- Chemical and Physical Properties

Names and Identifiers

    • Benzo[b]thiophene-2-carboxamide, 3-chloro-6-methyl-
    • 3-chloro-6-methyl-1-benzothiophene-2-carboxamide
    • 3-chloro-6-methylbenzo[b]thiophene-2-carboxamide
    • AK-968/15359815
    • AKOS003271548
    • HMS1585H01
    • DTXSID10358024
    • MFCD01923404
    • STK425854
    • AB00102913-01
    • 3-Chloro-6-methyl-benzo[b]thiophene-2-carboxylic acid amide
    • CS-0327658
    • SR-01000228699
    • SR-01000228699-1
    • Cambridge id 6132471
    • SCHEMBL9178739
    • 34586-87-3
    • MDL： MFCD01923404
    • Inchi： 1S/C10H8ClNOS/c1-5-2-3-6-7(4-5)14-9(8(6)11)10(12)13/h2-4H,1H3,(H2,12,13)
    • InChI Key： NUIWQDQQDZQXOL-UHFFFAOYSA-N
    • SMILES： ClC1=C(C(N)=O)SC2C=C(C)C=CC=21

Computed Properties

  • Exact Mass: 225.00164
  • Monoisotopic Mass: 225.0015127g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 1
  • Complexity: 248
  • 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: 3.1
  • Topological Polar Surface Area: 71.3?2

Experimental Properties

  • PSA: 43.09

Benzo[b]thiophene-2-carboxamide, 3-chloro-6-methyl- Pricemore >>

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abcr
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abcr
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