Cas no 92714-90-4 (2,4-Dibromo-6-[(3,5-dichloro-4-hydroxyphenyl)methyl]phenol)

2,4-Dibromo-6-[(3,5-dichloro-4-hydroxyphenyl)methyl]phenol structure
92714-90-4 structure
Product Name:2,4-Dibromo-6-[(3,5-dichloro-4-hydroxyphenyl)methyl]phenol
CAS No:92714-90-4
MF:C13H8Br2Cl2O2
MW:426.915420532227
CID:2815717
PubChem ID:71329316
Update Time:2025-04-21

2,4-Dibromo-6-[(3,5-dichloro-4-hydroxyphenyl)methyl]phenol Chemical and Physical Properties

Names and Identifiers

    • 92714-90-4
    • 2,4-Dibromo-6-[(3,5-dichloro-4-hydroxyphenyl)methyl]phenol
    • DTXSID00758155
    • Inchi: 1S/C13H8Br2Cl2O2/c14-8-4-7(12(18)9(15)5-8)1-6-2-10(16)13(19)11(17)3-6/h2-5,18-19H,1H2
    • InChI Key: OIWZKLQJDPSZKZ-UHFFFAOYSA-N
    • SMILES: BrC1=CC(=CC(=C1O)CC1C=C(C(=C(C=1)Cl)O)Cl)Br

Computed Properties

  • Exact Mass: 425.82476Da
  • Monoisotopic Mass: 423.82681Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 19
  • Rotatable Bond Count: 2
  • Complexity: 296
  • 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: 5.8
  • Topological Polar Surface Area: 40.5?2
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