Cas no 73501-16-3 (5,7-Octadienoic acid)

5,7-Octadienoic acid structure
5,7-Octadienoic acid structure
Product Name:5,7-Octadienoic acid
CAS No:73501-16-3
MF:C8H12O2
MW:140.179682731628
CID:2672308
Update Time:2023-08-06

5,7-Octadienoic acid Chemical and Physical Properties

Names and Identifiers

    • 5,7-Octadienoic acid
    • LMFA01030442
    • (E)-5,7-Octadienoic acid
    • C8:2n-1,3
    • Inchi: 1S/C8H12O2/c1-2-3-4-5-6-7-8(9)10/h2-4H,1,5-7H2,(H,9,10)/b4-3+
    • InChI Key: TXORZOOFFDVXQY-ONEGZZNKSA-N
    • SMILES: OC(CCC/C=C/C=C)=O

Computed Properties

  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 5
  • Complexity: 136
  • Topological Polar Surface Area: 37.3
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