Cas no 221061-14-9 (2-Bromo-5-methylthiophene-3-carboxylic acid)

2-Bromo-5-methylthiophene-3-carboxylic acid structure
221061-14-9 structure
Product Name:2-Bromo-5-methylthiophene-3-carboxylic acid
CAS No:221061-14-9
MF:C6H5BrO2S
MW:221.071699857712
CID:1011476
PubChem ID:11117589
Update Time:2025-04-20

2-Bromo-5-methylthiophene-3-carboxylic acid Chemical and Physical Properties

Names and Identifiers

    • 2-Bromo-5-methylthiophene-3-carboxylic acid
    • 2-bromo-5-methyl-3-Thiophenecarboxylic acid
    • 3-Thiophenecarboxylic acid, 2-bromo-5-methyl-
    • LogP
    • SCHEMBL2825614
    • EN300-107064
    • DTXSID70455841
    • MFCD11109385
    • 2-Bromo-5-methylthiophene-3-carboxylicacid
    • CS-0308082
    • 221061-14-9
    • DZMYKWBJZZTINV-UHFFFAOYSA-N
    • WIA06114
    • 2-Bromo-5-methylthiophene-3-carboxylic acid 97%
    • AKOS015834930
    • Z1269194127
    • AS-43694
    • 2-bromo-5-methyl-thiophene-3-carboxylic Acid
    • Inchi： 1S/C6H5BrO2S/c1-3-2-4(6(8)9)5(7)10-3/h2H,1H3,(H,8,9)
    • InChI Key： DZMYKWBJZZTINV-UHFFFAOYSA-N
    • SMILES： BrC1=C(C(=O)O)C=C(C)S1

Computed Properties

  • Exact Mass: 219.91935
  • Monoisotopic Mass: 219.91936g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 1
  • Complexity: 151
  • 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: 2.6
  • Topological Polar Surface Area: 65.5?2

Experimental Properties

  • PSA: 37.3

2-Bromo-5-methylthiophene-3-carboxylic acid Pricemore >>

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