Cas no 16754-74-8 (Methyl 2-oxo-3-(triphenyl-lambda~5~-phosphanylidene)propanoate)

Methyl 2-oxo-3-(triphenyl-lambda~5~-phosphanylidene)propanoate structure
16754-74-8 structure
Product Name:Methyl 2-oxo-3-(triphenyl-lambda~5~-phosphanylidene)propanoate
CAS No:16754-74-8
MF:C22H19O3P
MW:362.358227014542
CID:2781345
PubChem ID:15261017
Update Time:2025-04-21

Methyl 2-oxo-3-(triphenyl-lambda~5~-phosphanylidene)propanoate Chemical and Physical Properties

Names and Identifiers

    • DTXSID80570630
    • 16754-74-8
    • Methyl 2-oxo-3-(triphenyl-l5-phosphaneylidene)propanoate
    • Methyl 2-oxo-3-(triphenyl-lambda~5~-phosphanylidene)propanoate
    • Inchi: 1S/C22H19O3P/c1-25-22(24)21(23)17-26(18-11-5-2-6-12-18,19-13-7-3-8-14-19)20-15-9-4-10-16-20/h2-17H,1H3
    • InChI Key: KVMLLRBFVANCPE-UHFFFAOYSA-N
    • SMILES: P(=CC(C(=O)OC)=O)(C1C=CC=CC=1)(C1C=CC=CC=1)C1C=CC=CC=1

Computed Properties

  • Exact Mass: 362.10718146Da
  • Monoisotopic Mass: 362.10718146Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 26
  • Rotatable Bond Count: 6
  • Complexity: 483
  • 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: 3.9
  • Topological Polar Surface Area: 43.4?2
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