Cas no 16003-66-0 (Benzene,[(dibromomethyl)sulfonyl]-)

Benzene,[(dibromomethyl)sulfonyl]- structure
16003-66-0 structure
Product Name:Benzene,[(dibromomethyl)sulfonyl]-
CAS No:16003-66-0
MF:C7H6Br2O2S
MW:313.994339466095
CID:179142
PubChem ID:275605
Update Time:2025-04-19

Benzene,[(dibromomethyl)sulfonyl]- Chemical and Physical Properties

Names and Identifiers

    • Benzene,[(dibromomethyl)sulfonyl]-
    • dibromomethylsulfonylbenzene
    • 2-(phenylsulfonamido)acetic acid
    • Dibrommethyl-phenyl-sulfon
    • dibromomethyl-phenyl sulfone
    • Dibromomethyl-phenylsulfinat
    • Dibrom-phenylsulfon-methan
    • N-benzenesulfonyl-glycine
    • N-benzenesulphonylglycine
    • N-Phenylsulfonylglycine
    • Phenyl-dibrommethylsulfon
    • phenylsulfonylaminoacetic acid
    • phenylsulfonyldibromomethane
    • NSC-122527
    • SCHEMBL9849677
    • NSC122527
    • RLOBRCXIAWJACX-UHFFFAOYSA-N
    • (Dibromomethanesulfonyl)benzene
    • [(dibromomethyl)sulfonyl]benzene
    • DTXSID80936212
    • 16003-66-0
    • dibromomethyl phenyl sulfone
    • Inchi: 1S/C7H6Br2O2S/c8-7(9)12(10,11)6-4-2-1-3-5-6/h1-5,7H
    • InChI Key: RLOBRCXIAWJACX-UHFFFAOYSA-N
    • SMILES: BrC(S(C1C=CC=CC=1)(=O)=O)Br

Computed Properties

  • Exact Mass: 311.84600
  • Monoisotopic Mass: 311.846
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 2
  • Complexity: 224
  • 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: 2.9
  • Topological Polar Surface Area: 42.5?2

Experimental Properties

  • Density: 1.987
  • Boiling Point: 370.1°Cat760mmHg
  • Flash Point: 177.6°C
  • Refractive Index: 1.622
  • PSA: 42.52000
  • LogP: 3.61450
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