Cas no 1256358-57-2 (4-(4-Chloro-2-fluorophenoxy)phenylboronic acid)

4-(4-Chloro-2-fluorophenoxy)phenylboronic acid structure
1256358-57-2 structure
Product Name:4-(4-Chloro-2-fluorophenoxy)phenylboronic acid
CAS No:1256358-57-2
MF:C12H9BClFO3
MW:266.460466146469
MDL:MFCD14581927
CID:828652
PubChem ID:53216755
Update Time:2025-04-19

4-(4-Chloro-2-fluorophenoxy)phenylboronic acid Chemical and Physical Properties

Names and Identifiers

    • (4-(4-Chloro-2-fluorophenoxy)phenyl)boronic acid
    • 4-(4-Chloro-2-fluorophenoxy)phenylboronic acid
    • BS-19874
    • (4-(4-Chloro-2-fluorophenoxy)phenyl)boronicacid
    • DB-357449
    • MFCD14581927
    • SCHEMBL15710969
    • 1256358-57-2
    • [4-(4-chloro-2-fluorophenoxy)phenyl]boronic acid
    • AKOS015850214
    • Boronic acid, B-[4-(4-chloro-2-fluorophenoxy)phenyl]-
    • CS-0174601
    • DTXSID10681905
    • MDL: MFCD14581927
    • Inchi: 1S/C12H9BClFO3/c14-9-3-6-12(11(15)7-9)18-10-4-1-8(2-5-10)13(16)17/h1-7,16-17H
    • InChI Key: UQQJHJBZZCELBT-UHFFFAOYSA-N
    • SMILES: ClC1C=CC(=C(C=1)F)OC1C=CC(B(O)O)=CC=1

Computed Properties

  • Exact Mass: 266.03200
  • Monoisotopic Mass: 266.0317302g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 3
  • Complexity: 262
  • 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
  • Topological Polar Surface Area: 49.7?2

Experimental Properties

  • PSA: 49.69000
  • LogP: 1.95120

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