Cas no 54582-61-5 (2-Bromo-4-(4-chlorophenoxy)phenol)

2-Bromo-4-(4-chlorophenoxy)phenol structure
54582-61-5 structure
Product Name:2-Bromo-4-(4-chlorophenoxy)phenol
CAS No:54582-61-5
MF:C12H8BrClO2
MW:299.547721862793
CID:2831300
PubChem ID:22752765
Update Time:2025-04-21

2-Bromo-4-(4-chlorophenoxy)phenol Chemical and Physical Properties

Names and Identifiers

    • SCHEMBL25876566
    • 54582-61-5
    • DTXSID30628074
    • 2-Bromo-4-(4-chlorophenoxy)phenol
    • Inchi: 1S/C12H8BrClO2/c13-11-7-10(5-6-12(11)15)16-9-3-1-8(14)2-4-9/h1-7,15H
    • InChI Key: AFKKEWORHAUPEO-UHFFFAOYSA-N
    • SMILES: BrC1=C(C=CC(=C1)OC1C=CC(=CC=1)Cl)O

Computed Properties

  • Exact Mass: 297.93962Da
  • Monoisotopic Mass: 297.93962Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 2
  • Complexity: 219
  • 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: 4.7
  • Topological Polar Surface Area: 29.5?2
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