Cas no 155701-60-3 (Benzaldehyde, 4-[(1Z)-1,2-diphenyl-1-butenyl]-)

Benzaldehyde, 4-[(1Z)-1,2-diphenyl-1-butenyl]- structure
155701-60-3 structure
Product Name:Benzaldehyde, 4-[(1Z)-1,2-diphenyl-1-butenyl]-
CAS No:155701-60-3
MF:C23H20O
MW:312.404306411743
CID:1330765
PubChem ID:54280993
Update Time:2025-04-20

Benzaldehyde, 4-[(1Z)-1,2-diphenyl-1-butenyl]- Chemical and Physical Properties

Names and Identifiers

    • Benzaldehyde, 4-[(1Z)-1,2-diphenyl-1-butenyl]-
    • 4-(1,2-diphenylbut-1-enyl)benzaldehyde
    • 155701-60-3
    • 4-(1,2-Diphenylbut-1-en-1-yl)benzaldehyde
    • DTXSID90710282
    • Inchi: 1S/C23H20O/c1-2-22(19-9-5-3-6-10-19)23(20-11-7-4-8-12-20)21-15-13-18(17-24)14-16-21/h3-17H,2H2,1H3
    • InChI Key: RQTSKIMHMFBGPY-UHFFFAOYSA-N
    • SMILES: O=CC1C=CC(=CC=1)C(C1C=CC=CC=1)=C(C1C=CC=CC=1)CC

Computed Properties

  • Exact Mass: 312.1515
  • Monoisotopic Mass: 312.151415257g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 24
  • Rotatable Bond Count: 5
  • Complexity: 415
  • 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: 6.6
  • Topological Polar Surface Area: 17.1?2

Experimental Properties

  • PSA: 17.07
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