Cas no 141060-36-8 (Methanone, 1,3-phenylenebis[[1,1'-biphenyl]-4-yl-)

Methanone, 1,3-phenylenebis[[1,1'-biphenyl]-4-yl- structure
141060-36-8 structure
Product Name:Methanone, 1,3-phenylenebis[[1,1'-biphenyl]-4-yl-
CAS No:141060-36-8
MF:C32H22O2
MW:438.515888690948
CID:1300632
PubChem ID:19009361
Update Time:2025-04-20

Methanone, 1,3-phenylenebis[[1,1'-biphenyl]-4-yl- Chemical and Physical Properties

Names and Identifiers

    • Methanone, 1,3-phenylenebis[[1,1'-biphenyl]-4-yl-
    • [3-(4-phenylbenzoyl)phenyl]-(4-phenylphenyl)methanone
    • (1,3-Phenylene)bis[([1,1'-biphenyl]-4-yl)methanone]
    • DTXSID80597342
    • SCHEMBL9402150
    • 141060-36-8
    • Inchi: 1S/C32H22O2/c33-31(27-18-14-25(15-19-27)23-8-3-1-4-9-23)29-12-7-13-30(22-29)32(34)28-20-16-26(17-21-28)24-10-5-2-6-11-24/h1-22H
    • InChI Key: VLTKLVZRHKYFJN-UHFFFAOYSA-N
    • SMILES: O=C(C1C=CC(=CC=1)C1C=CC=CC=1)C1C=CC=C(C(C2C=CC(=CC=2)C2C=CC=CC=2)=O)C=1

Computed Properties

  • Exact Mass: 438.16206
  • Monoisotopic Mass: 438.161979940g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 34
  • Rotatable Bond Count: 6
  • Complexity: 599
  • 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: 7.9
  • Topological Polar Surface Area: 34.1?2

Experimental Properties

  • PSA: 34.14
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