Cas no 1256358-43-6 ((4-((2-Cyanobenzyl)oxy)phenyl)boronic acid)

(4-((2-Cyanobenzyl)oxy)phenyl)boronic acid structure
1256358-43-6 structure
Product Name:(4-((2-Cyanobenzyl)oxy)phenyl)boronic acid
CAS No:1256358-43-6
MF:C14H12BNO3
MW:253.060983657837
MDL:MFCD12634045
CID:828660
PubChem ID:43145310
Update Time:2025-09-27

(4-((2-Cyanobenzyl)oxy)phenyl)boronic acid Chemical and Physical Properties

Names and Identifiers

    • (4-((2-Cyanobenzyl)oxy)phenyl)boronic acid
    • 4-(2-CYANOPHENYLMETHOXY)PHENYLBORONIC ACID
    • MFCD12634045
    • SCHEMBL15331327
    • [4-[(2-cyanophenyl)methoxy]phenyl]boronic acid
    • DB-366709
    • 1256358-43-6
    • 4-[(2-CYANOPHENYL)METHOXY]PHENYLBORONIC ACID
    • BS-19852
    • Boronic acid, B-[4-[(2-cyanophenyl)methoxy]phenyl]-
    • {4-[(2-Cyanophenyl)methoxy]phenyl}boronic acid
    • AKOS009319813
    • (4-((2-Cyanobenzyl)oxy)phenyl)boronicacid
    • CS-0174552
    • DTXSID40655553
    • MDL: MFCD12634045
    • Inchi: 1S/C14H12BNO3/c16-9-11-3-1-2-4-12(11)10-19-14-7-5-13(6-8-14)15(17)18/h1-8,17-18H,10H2
    • InChI Key: GQJXMTNIYDUFJH-UHFFFAOYSA-N
    • SMILES: O(C1C=CC(B(O)O)=CC=1)CC1C=CC=CC=1C#N

Computed Properties

  • Exact Mass: 253.09100
  • Monoisotopic Mass: 253.0910234g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 19
  • Rotatable Bond Count: 4
  • Complexity: 320
  • 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: 73.5?2

Experimental Properties

  • PSA: 73.48000
  • LogP: 0.81708

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