Cas no 259209-23-9 (Boronic acid,(2-hydroxy-3,5-dimethylphenyl)- (9CI))

Boronic acid,(2-hydroxy-3,5-dimethylphenyl)- (9CI) structure
259209-23-9 structure
Product Name:Boronic acid,(2-hydroxy-3,5-dimethylphenyl)- (9CI)
CAS No:259209-23-9
MF:C8H11BO3
MW:165.982142686844
CID:247144
PubChem ID:18617001
Update Time:2025-04-19

Boronic acid,(2-hydroxy-3,5-dimethylphenyl)- (9CI) Chemical and Physical Properties

Names and Identifiers

    • Boronic acid,(2-hydroxy-3,5-dimethylphenyl)- (9CI)
    • (2-hydroxy-3,5-dimethylphenyl)boronic acid
    • Boronic acid, (2-hydroxy-3,5-dimethylphenyl)- (9CI)
    • 259209-23-9
    • SCHEMBL7232450
    • KUOLZZBFTRCDLA-UHFFFAOYSA-N
    • (2-hydroxy-3,5-dimethylphenyl)boronicacid
    • DTXSID10595159
    • (2-hydroxy-3, 5-dimethylphenyl)boronic acid
    • 2-HYDROXY-3,5-DIMETHYLPHENYLBORONIC ACID
    • 3,5-Dimethyl-2-hydroxyphenylboronic acid
    • Inchi: 1S/C8H11BO3/c1-5-3-6(2)8(10)7(4-5)9(11)12/h3-4,10-12H,1-2H3
    • InChI Key: KUOLZZBFTRCDLA-UHFFFAOYSA-N
    • SMILES: OC1C(B(O)O)=CC(C)=CC=1C

Computed Properties

  • Exact Mass: 165.08373
  • Monoisotopic Mass: 166.0801244g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 1
  • Complexity: 151
  • 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: 60.7?2

Experimental Properties

  • PSA: 60.69
  • LogP: -0.31120

Boronic acid,(2-hydroxy-3,5-dimethylphenyl)- (9CI) Pricemore >>

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