Cas no 77347-19-4 (Methanone,1,1'-(2-hydroxy-5-methyl-1,3-phenylene)bis[1-phenyl-)

Methanone,1,1'-(2-hydroxy-5-methyl-1,3-phenylene)bis[1-phenyl- structure
77347-19-4 structure
Product Name:Methanone,1,1'-(2-hydroxy-5-methyl-1,3-phenylene)bis[1-phenyl-
CAS No:77347-19-4
MF:C21H16O3
MW:316.349946022034
CID:578389
PubChem ID:349808
Update Time:2025-04-19

Methanone,1,1'-(2-hydroxy-5-methyl-1,3-phenylene)bis[1-phenyl- Chemical and Physical Properties

Names and Identifiers

    • (3-benzoyl-2-hydroxy-5-methylphenyl)-phenylmethanone
    • (2-hydroxy-5-methyl-1,3-phenylene)bis(phenylmethanone)
    • (5-methyl-2-hydroxy-1,3-phenylene)bis(phenylmethanone)
    • 1,3-dibenzoyl-2-hydroxy-5-methylbenzene
    • 2,6-dibenzoyl-4-methylphenol
    • 4-methyl-2,6-dibenzoylphenol
    • AC1L8BDP
    • CHEMBL183982
    • NSC409657
    • SureCN5712155
    • 77347-19-4
    • NSC-409657
    • DTXSID80325324
    • SCHEMBL5712155
    • Methanone,1,1'-(2-hydroxy-5-methyl-1,3-phenylene)bis[1-phenyl-
    • Inchi: 1S/C21H16O3/c1-14-12-17(19(22)15-8-4-2-5-9-15)21(24)18(13-14)20(23)16-10-6-3-7-11-16/h2-13,24H,1H3
    • InChI Key: PRRBLJKTEPAZOD-UHFFFAOYSA-N
    • SMILES: OC1C(C(C2C=CC=CC=2)=O)=CC(C)=CC=1C(C1C=CC=CC=1)=O

Computed Properties

  • Exact Mass: 316.10998
  • Monoisotopic Mass: 316.11
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 24
  • Rotatable Bond Count: 4
  • Complexity: 406
  • 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: 5.2
  • Topological Polar Surface Area: 54.4?2

Experimental Properties

  • Density: 1.215
  • Boiling Point: 477°C at 760 mmHg
  • Flash Point: 256.4°C
  • Refractive Index: 1.629
  • PSA: 54.37
  • LogP: 4.16260
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