Cas no 259209-33-1 (Boronic acid,[2-hydroxy-5-(1-methylethyl)phenyl]- (9CI))

Boronic acid,[2-hydroxy-5-(1-methylethyl)phenyl]- (9CI) structure
259209-33-1 structure
Product Name:Boronic acid,[2-hydroxy-5-(1-methylethyl)phenyl]- (9CI)
CAS No:259209-33-1
MF:C9H13BO3
MW:180.008723020554
CID:247147
PubChem ID:18616949
Update Time:2025-04-19

Boronic acid,[2-hydroxy-5-(1-methylethyl)phenyl]- (9CI) Chemical and Physical Properties

Names and Identifiers

    • Boronic acid,[2-hydroxy-5-(1-methylethyl)phenyl]- (9CI)
    • (2-hydroxy-5-propan-2-ylphenyl)boronic acid
    • Boronic acid, [2-hydroxy-5-(1-methylethyl)phenyl]- (9CI)
    • starbld0018452
    • 259209-33-1
    • EN300-6489309
    • [2-Hydroxy-5-(propan-2-yl)phenyl]boronic acid
    • Z1504683012
    • (2-Hydroxy-5-isopropylphenyl)boronic acid
    • DTXSID70595155
    • SCHEMBL7235456
    • Inchi： 1S/C9H13BO3/c1-6(2)7-3-4-9(11)8(5-7)10(12)13/h3-6,11-13H,1-2H3
    • InChI Key： WCFJCIMGOCZBLG-UHFFFAOYSA-N
    • SMILES： OC1C=CC(=CC=1B(O)O)C(C)C

Computed Properties

  • Exact Mass: 180.0957744g/mol
  • Monoisotopic Mass: 180.0957744g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 2
  • Complexity: 161
  • 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: 60.69000
  • LogP: 0.19540

Boronic acid,[2-hydroxy-5-(1-methylethyl)phenyl]- (9CI) Pricemore >>

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