Cas no 827608-99-1 (2-Butanone, 4-hydroxy-1,4-diphenyl-, (4R)-)

2-Butanone, 4-hydroxy-1,4-diphenyl-, (4R)- structure
827608-99-1 structure
Product Name:2-Butanone, 4-hydroxy-1,4-diphenyl-, (4R)-
CAS No:827608-99-1
MF:C16H16O2
MW:240.297044754028
CID:683129
PubChem ID:71417278
Update Time:2025-04-19

2-Butanone, 4-hydroxy-1,4-diphenyl-, (4R)- Chemical and Physical Properties

Names and Identifiers

    • 2-Butanone, 4-hydroxy-1,4-diphenyl-, (4R)-
    • (4R)-4-hydroxy-1,4-diphenylbutan-2-one
    • 827608-99-1
    • DTXSID60836620
    • Inchi: 1S/C16H16O2/c17-15(11-13-7-3-1-4-8-13)12-16(18)14-9-5-2-6-10-14/h1-10,16,18H,11-12H2/t16-/m1/s1
    • InChI Key: MHWPULQIWQNQML-MRXNPFEDSA-N
    • SMILES: O[C@@H](C1C=CC=CC=1)CC(CC1C=CC=CC=1)=O

Computed Properties

  • Exact Mass: 240.115029749g/mol
  • Monoisotopic Mass: 240.115029749g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 5
  • Complexity: 250
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 1
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2.3
  • Topological Polar Surface Area: 37.3?2
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