ChemSpider 2D Image | 2,1-Benzoxaborole-1,6(7aH)-diol | C7H7BO3

2,1-Benzoxaborole-1,6(7aH)-diol

  • Molecular FormulaC7H7BO3
  • Average mass149.940 Da
  • Monoisotopic mass150.048828 Da
  • ChemSpider ID60597340

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

2,1-Benzoxaborol-1,6(7aH)-diol [German] [ACD/IUPAC Name]
2,1-Benzoxaborol-6-ol, 1,7a-dihydro-1-hydroxy- [ACD/Index Name]
2,1-Benzoxaborole-1,6(7aH)-diol [ACD/IUPAC Name]
2,1-Benzoxaborole-1,6(7aH)-diol [French] [ACD/IUPAC Name]
1196473-37-6 [RN]
1-hydroxy-3H-2,1-benzoxaborol-6-ol
benzo[c][1,2]oxaborole-1,6(3H)-diol
MFCD22200367 [MDL number]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.4±0.1 g/cm3
Boiling Point: 377.1±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 72.3±6.0 kJ/mol
Flash Point: 181.9±30.7 °C
Index of Refraction: 1.599
Molar Refractivity: 37.9±0.4 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 0
#Rule of 5 Violations:
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area: 50 Å2
Polarizability: 15.0±0.5 10-24cm3
Surface Tension: 48.8±5.0 dyne/cm
Molar Volume: 110.9±5.0 cm3

Click to predict properties on the Chemicalize site


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