Cas no 871125-96-1 (4-(3-Chlorophenylmethoxy)phenylboronic acid)

4-(3-Chlorophenylmethoxy)phenylboronic acid structure
871125-96-1 structure
Product Name:4-(3-Chlorophenylmethoxy)phenylboronic acid
CAS No:871125-96-1
MF:C13H12BClO3
MW:262.496582984924
MDL:MFCD10698491
CID:828012
PubChem ID:43327882
Update Time:2025-04-19

4-(3-Chlorophenylmethoxy)phenylboronic acid Chemical and Physical Properties

Names and Identifiers

    • (4-((3-Chlorobenzyl)oxy)phenyl)boronic acid
    • [4-[(3-chlorophenyl)methoxy]phenyl]boronic acid
    • 4-(3-ChlorophenylMethoxy)phenylboronic acid
    • WJB12596
    • MFCD10698491
    • BS-24253
    • 871125-96-1
    • SCHEMBL2563261
    • AKOS009319814
    • AB62229
    • (4-((3-Chlorobenzyl)oxy)phenyl)boronicacid
    • CS-0175215
    • 4-(3'-CHLOROBENZYLOXY)PHENYLBORONIC ACID
    • {4-[(3-Chlorophenyl)methoxy]phenyl}boronic acid
    • DTXSID70655849
    • DB-357412
    • 4-(3-Chlorophenylmethoxy)phenylboronic acid
    • MDL： MFCD10698491
    • Inchi： 1S/C13H12BClO3/c15-12-3-1-2-10(8-12)9-18-13-6-4-11(5-7-13)14(16)17/h1-8,16-17H,9H2
    • InChI Key： DFIQBPGCTYISHA-UHFFFAOYSA-N
    • SMILES： ClC1=CC=CC(=C1)COC1C=CC(B(O)O)=CC=1

Computed Properties

  • Exact Mass: 262.0568021g/mol
  • Monoisotopic Mass: 262.0568021g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 4
  • Complexity: 244
  • 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

4-(3-Chlorophenylmethoxy)phenylboronic acid Security Information

  • Hazard Category Code： 36/37/38
  • Safety Instruction： 26-36
  • Hazardous Material Identification： Xi

4-(3-Chlorophenylmethoxy)phenylboronic acid Pricemore >>

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