Cas no 92614-57-8 (4-(Chlorosulfonyl)methylbenzoic Acid)

4-(Chlorosulfonyl)methylbenzoic Acid structure
92614-57-8 structure
Product Name:4-(Chlorosulfonyl)methylbenzoic Acid
CAS No:92614-57-8
MF:C8H7ClO4S
MW:234.656780481339
CID:4327644
PubChem ID:19764006
Update Time:2025-04-24

4-(Chlorosulfonyl)methylbenzoic Acid Chemical and Physical Properties

Names and Identifiers

    • Benzoic acid, 4-[(chlorosulfonyl)methyl]-
    • 4-Chlorosulfonylmethyl-benzoic acid
    • SCHEMBL18389723
    • 4-((Chlorosulfonyl)methyl)benzoicacid
    • 4-[(chlorosulfonyl)methyl]benzoic acid
    • CS-0234616
    • 92614-57-8
    • G85929
    • MFCD18324286
    • EN300-144532
    • 4-((Chlorosulfonyl)methyl)benzoic acid
    • SDA61457
    • 4-((Chlorosulfonyl)methyl)-benzoic acid
    • AKOS006335785
    • 4-(chlorosulfonylmethyl)benzoic acid
    • 4-(Chlorosulfonyl)methylbenzoic Acid
    • Inchi: 1S/C8H7ClO4S/c9-14(12,13)5-6-1-3-7(4-2-6)8(10)11/h1-4H,5H2,(H,10,11)
    • InChI Key: DAGYFDUEPISFBZ-UHFFFAOYSA-N
    • SMILES: C(O)(=O)C1=CC=C(CS(Cl)(=O)=O)C=C1

Computed Properties

  • Exact Mass: 233.9753576Da
  • Monoisotopic Mass: 233.9753576Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 3
  • Complexity: 298
  • 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: 1.8
  • Topological Polar Surface Area: 79.8?2

Experimental Properties

  • Density: Not available
  • Melting Point: Not available
  • Boiling Point: Not available
  • Flash Point: Not available
  • Vapor Pressure: Not available

4-(Chlorosulfonyl)methylbenzoic Acid Pricemore >>

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