Cas no 79279-54-2 (4-(Chlorosulfonyl)thiophene-2-carboxylic Acid)

4-(Chlorosulfonyl)thiophene-2-carboxylic Acid structure
79279-54-2 structure
Product Name:4-(Chlorosulfonyl)thiophene-2-carboxylic Acid
CAS No:79279-54-2
MF:C5H3ClO4S2
MW:226.657918214798
CID:1796586
PubChem ID:12704281
Update Time:2025-04-21

4-(Chlorosulfonyl)thiophene-2-carboxylic Acid Chemical and Physical Properties

Names and Identifiers

    • 2-Thiophenecarboxylic acid, 4-(chlorosulfonyl)-
    • 4-chlorosulfonylthiophene-2-carboxylic acid
    • DTXSID60507444
    • AT16960
    • SCHEMBL13888923
    • EN300-40927
    • 4-(chlorosulfonyl)thiophene-2-carboxylic acid
    • CS-0248668
    • DB-152865
    • 4-(chlorosulfonyl)thiophene-2-carboxylicacid
    • AKOS006223658
    • 4-(Chlorosulfonyl)-2-thiophenecarboxylic acid
    • 79279-54-2
    • 4-(Chlorosulfonyl)thiophene-2-carboxylic Acid
    • Inchi: 1S/C5H3ClO4S2/c6-12(9,10)3-1-4(5(7)8)11-2-3/h1-2H,(H,7,8)
    • InChI Key: JHUDMONBNZNYHU-UHFFFAOYSA-N
    • SMILES: ClS(C1=CSC(C(=O)O)=C1)(=O)=O

Computed Properties

  • Exact Mass: 225.9161286g/mol
  • Monoisotopic Mass: 225.9161286g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 2
  • Complexity: 280
  • 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: 1.5
  • Topological Polar Surface Area: 108?2

Experimental Properties

  • Density: 1.8±0.1 g/cm3
  • Boiling Point: 424.6±30.0 °C at 760 mmHg
  • Flash Point: 210.6±24.6 °C
  • Vapor Pressure: 0.0±1.1 mmHg at 25°C

4-(Chlorosulfonyl)thiophene-2-carboxylic Acid Security Information

4-(Chlorosulfonyl)thiophene-2-carboxylic Acid Pricemore >>

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