Cas no 1367919-94-5 (3-Thiophenecarboxylic acid, 4-bromo-5-methyl-)

3-Thiophenecarboxylic acid, 4-bromo-5-methyl- structure
1367919-94-5 structure
Product Name:3-Thiophenecarboxylic acid, 4-bromo-5-methyl-
CAS No:1367919-94-5
MF:C6H5BrO2S
MW:221.071699857712
CID:5851112
PubChem ID:82374946
Update Time:2024-01-14

3-Thiophenecarboxylic acid, 4-bromo-5-methyl- Chemical and Physical Properties

Names and Identifiers

    • 3-Thiophenecarboxylic acid, 4-bromo-5-methyl-
    • 4-bromo-5-methylthiophene-3-carboxylic acid
    • 1367919-94-5
    • Z1416165168
    • EN300-7303769
    • Inchi: 1S/C6H5BrO2S/c1-3-5(7)4(2-10-3)6(8)9/h2H,1H3,(H,8,9)
    • InChI Key: NZBGXKKTSGFSIY-UHFFFAOYSA-N
    • SMILES: C1SC(C)=C(Br)C=1C(O)=O

Computed Properties

  • Exact Mass: 219.91936g/mol
  • Monoisotopic Mass: 219.91936g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • 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: 2.2
  • Topological Polar Surface Area: 65.5?2

3-Thiophenecarboxylic acid, 4-bromo-5-methyl- Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
Enamine
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1367919-94-5 95.0%
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1367919-94-5 95.0%
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Enamine
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Aaron
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