Cas no 6462-34-6 (1,1'-Biphenyl,4-(methylsulfonyl)-)

1,1'-Biphenyl,4-(methylsulfonyl)- structure
6462-34-6 structure
Product Name:1,1'-Biphenyl,4-(methylsulfonyl)-
CAS No:6462-34-6
MF:C13H12O2S
MW:232.298182487488
CID:500625
PubChem ID:515119
Update Time:2025-04-19

1,1'-Biphenyl,4-(methylsulfonyl)- Chemical and Physical Properties

Names and Identifiers

    • 1,1'-Biphenyl,4-(methylsulfonyl)-
    • 1-methylsulfonyl-4-phenylbenzene
    • 4-METHANESULFONYL-BIPHENYL
    • 1-Methansulfonyl-4-phenyl-benzol
    • 4-(methylsulfonyl)-1,1'-biphenyl
    • 4-(methylsulfonyl)biphenyl
    • 4-methanesulfonyl-1-phenylbenzene
    • AC1LAJZ6
    • biphenyl-4-yl-methyl sulfone
    • Biphenyl-4-yl-methyl-sulfon
    • CHEBI:395501
    • CHEMBL178795
    • CTK5C1492
    • HMS559O20
    • Maybridge1_006488
    • SureCN1687503
    • BDBM50137902
    • 1-methylsulfonyl-4-phenyl-benzene
    • AKOS015963018
    • 1,1'-Biphenyl, 4-(methylsulfonyl)-
    • AC-18798
    • DTXSID70333630
    • 6462-34-6
    • 5-(4-Fluoro-phenyl)-thiophene-2-carboxylic acid
    • SCHEMBL1687503
    • Inchi: 1S/C13H12O2S/c1-16(14,15)13-9-7-12(8-10-13)11-5-3-2-4-6-11/h2-10H,1H3
    • InChI Key: KPLBNSVPNZGZEH-UHFFFAOYSA-N
    • SMILES: S(C)(C1C=CC(=CC=1)C1C=CC=CC=1)(=O)=O

Computed Properties

  • Exact Mass: 232.05586
  • Monoisotopic Mass: 232.05580079g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 2
  • Complexity: 301
  • 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: 3.2
  • Topological Polar Surface Area: 42.5?2

Experimental Properties

  • Density: 1.182
  • Boiling Point: 415.7°C at 760 mmHg
  • Flash Point: 257.4°C
  • Refractive Index: 1.574
  • PSA: 34.14
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