Cas no 869959-14-8 (2-Thiophenecarboxaldehyde,5-(4-formylphenyl)-)

2-Thiophenecarboxaldehyde,5-(4-formylphenyl)- structure
869959-14-8 structure
Product Name:2-Thiophenecarboxaldehyde,5-(4-formylphenyl)-
CAS No:869959-14-8
MF:C12H8O2S
MW:216.255722045898
CID:719102
PubChem ID:53426320
Update Time:2025-04-19

2-Thiophenecarboxaldehyde,5-(4-formylphenyl)- Chemical and Physical Properties

Names and Identifiers

    • 2-Thiophenecarboxaldehyde,5-(4-formylphenyl)-
    • 4-(5-Formylthiophen-2-yl)benzaldehyde
    • 5-(4-formylphenyl)thiophene-2-carbaldehyde
    • 2-formyl-5-(4'-formylphenyl)thiophene
    • 2-formyl-5-(4'-formylthiophene)thiophene
    • 2-Thiophenecarboxaldehyde,5-(4-formylphenyl)
    • CS-0457525
    • DTXSID30699183
    • 869959-14-8
    • Inchi: 1S/C12H8O2S/c13-7-9-1-3-10(4-2-9)12-6-5-11(8-14)15-12/h1-8H
    • InChI Key: GXFWSZUPOMKXHH-UHFFFAOYSA-N
    • SMILES: S1C(C=O)=CC=C1C1C=CC(C=O)=CC=1

Computed Properties

  • Exact Mass: 216.02500
  • Monoisotopic Mass: 216.025
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 3
  • Complexity: 234
  • 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
  • Topological Polar Surface Area: 62.4A^2
  • XLogP3: 2.5

Experimental Properties

  • PSA: 62.38000
  • LogP: 3.04010
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