Cas no 902137-97-7 (Thiomorpholine,4-[(4-bromo-2-chlorophenyl)sulfonyl]-)

Thiomorpholine,4-[(4-bromo-2-chlorophenyl)sulfonyl]- structure
902137-97-7 structure
Product Name:Thiomorpholine,4-[(4-bromo-2-chlorophenyl)sulfonyl]-
CAS No:902137-97-7
MF:C10H11BrClNO2S2
MW:356.686838388443
CID:797606
PubChem ID:17750109
Update Time:2025-04-19

Thiomorpholine,4-[(4-bromo-2-chlorophenyl)sulfonyl]- Chemical and Physical Properties

Names and Identifiers

    • Thiomorpholine,4-[(4-bromo-2-chlorophenyl)sulfonyl]-
    • 4-(4-Bromo-2-chloro-benzenesulfonyl)-thiomorpholine
    • 4-(4-bromo-2-chlorophenyl)sulfonylthiomorpholine
    • 4-(4-Bromo-2-chlorobenzene-1-sulfonyl)thiomorpholine
    • DTXSID10590260
    • AKOS007125868
    • 902137-97-7
    • 4-(4-Bromo-2-chlorophenylsulfonyl)thiomorpholine
    • Inchi: 1S/C10H11BrClNO2S2/c11-8-1-2-10(9(12)7-8)17(14,15)13-3-5-16-6-4-13/h1-2,7H,3-6H2
    • InChI Key: UYOODSFFADHQBU-UHFFFAOYSA-N
    • SMILES: BrC1C=CC(=C(C=1)Cl)S(N1CCSCC1)(=O)=O

Computed Properties

  • Exact Mass: 354.91000
  • Monoisotopic Mass: 354.91031
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 2
  • Complexity: 354
  • 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
  • Topological Polar Surface Area: 71.1
  • XLogP3: 2.8

Experimental Properties

  • PSA: 71.06000
  • LogP: 3.85870
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