Cas no 918831-19-3 (2-Propenal, 3-(4-propoxyphenyl)-, (2E)-)

2-Propenal, 3-(4-propoxyphenyl)-, (2E)- structure
918831-19-3 structure
Product Name:2-Propenal, 3-(4-propoxyphenyl)-, (2E)-
CAS No:918831-19-3
MF:C12H14O2
MW:190.238363742828
CID:769930
PubChem ID:54498110
Update Time:2025-04-19

2-Propenal, 3-(4-propoxyphenyl)-, (2E)- Chemical and Physical Properties

Names and Identifiers

    • 2-Propenal, 3-(4-propoxyphenyl)-, (2E)-
    • 3-(4-propoxyphenyl)prop-2-enal
    • 918831-19-3
    • AKOS017883710
    • SCHEMBL9997584
    • DTXSID90711774
    • Inchi: 1S/C12H14O2/c1-2-10-14-12-7-5-11(6-8-12)4-3-9-13/h3-9H,2,10H2,1H3
    • InChI Key: NNLBGDDJGRNRDZ-UHFFFAOYSA-N
    • SMILES: O(C1C=CC(C=CC=O)=CC=1)CCC

Computed Properties

  • Exact Mass: 190.099379685g/mol
  • Monoisotopic Mass: 190.099379685g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 5
  • Complexity: 179
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 1
  • XLogP3: 2.7
  • Topological Polar Surface Area: 26.3?2
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