Cas no 933-72-2 (4-Bromo-2,3-thiophenedicarboxaldehyde)

4-Bromo-2,3-thiophenedicarboxaldehyde structure
933-72-2 structure
Product Name:4-Bromo-2,3-thiophenedicarboxaldehyde
CAS No:933-72-2
MF:C6H3BrO2S
MW:219.055819749832
CID:2196582
PubChem ID:42614189
Update Time:2025-04-21

4-Bromo-2,3-thiophenedicarboxaldehyde Chemical and Physical Properties

Names and Identifiers

    • 4-Bromo-2,3-thiophenedicarboxaldehyde
    • 4-bromothiophene-2,3-dicarbaldehyde
    • DTXCID00605812
    • B90018
    • 933-72-2
    • DTXSID30655062
    • Inchi: 1S/C6H3BrO2S/c7-5-3-10-6(2-9)4(5)1-8/h1-3H
    • InChI Key: UCGHJPAWVUCIDP-UHFFFAOYSA-N
    • SMILES: BrC1=CSC(C=O)=C1C=O

Computed Properties

  • Exact Mass: 217.90371Da
  • Monoisotopic Mass: 217.90371Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 2
  • 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: 1.6
  • Topological Polar Surface Area: 62.4?2
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