Cas no 61209-02-7 (3,4-dichlorothiophene-2-carboxylic acid)

3,4-dichlorothiophene-2-carboxylic acid structure
61209-02-7 structure
Product Name:3,4-dichlorothiophene-2-carboxylic acid
CAS No:61209-02-7
MF:C5H2Cl2O2S
MW:197.039178371429
CID:488335
PubChem ID:14639927
Update Time:2025-09-25

3,4-dichlorothiophene-2-carboxylic acid Chemical and Physical Properties

Names and Identifiers

    • 2-Thiophenecarboxylic acid, 3,4-dichloro-
    • 3,4-Dichlorothiophene-2-carboxylic acid
    • EN300-1700221
    • DTXSID10562467
    • AKOS000282047
    • SCHEMBL787848
    • E76184
    • BS-49710
    • dichloro-2-thiophene carboxylic
    • 61209-02-7
    • 3,4-Dichlorothiophene-2-carboxylicacid
    • DB-356610
    • 3,4-Dichlorothiophene-2-carboxylic Acid; 3,4-Dichloro-2-thiophenecarboxylic acid; 3,4-Dichlorothiophene-2-carboxylic acid; PCT Int. Appl. (2012), WO 2012035057 A2 20120322.
    • 3,4-dichlorothiophene-2-carboxylic acid
    • MDL: MFCD00159568
    • Inchi: 1S/C5H2Cl2O2S/c6-2-1-10-4(3(2)7)5(8)9/h1H,(H,8,9)
    • InChI Key: SHYXCAMRUUVZKJ-UHFFFAOYSA-N
    • SMILES: ClC1C(=CSC=1C(=O)O)Cl

Computed Properties

  • Exact Mass: 195.91536
  • Monoisotopic Mass: 195.9152559g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 1
  • Complexity: 153
  • 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: 2.7
  • Topological Polar Surface Area: 65.5?2

Experimental Properties

  • PSA: 37.3

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