ChemSpider 2D Image | (3-(2-Hydroxypropan-2-yl)pyridin-2-yl)boronic acid | C8H12BNO3

(3-(2-Hydroxypropan-2-yl)pyridin-2-yl)boronic acid

  • Molecular FormulaC8H12BNO3
  • Average mass180.997 Da
  • Monoisotopic mass181.091019 Da
  • ChemSpider ID26463140

More details:

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

(3-(2-Hydroxypropan-2-yl)pyridin-2-yl)boronic acid
[3-(2-Hydroxy-2-propanyl)-2-pyridinyl]boronic acid [ACD/IUPAC Name]
[3-(2-Hydroxy-2-propanyl)-2-pyridinyl]borsäure [German] [ACD/IUPAC Name]
1310384-99-6 [RN]
Acide [3-(2-hydroxy-2-propanyl)-2-pyridinyl]boronique [French] [ACD/IUPAC Name]
Boronic acid, B-[3-(1-hydroxy-1-methylethyl)-2-pyridinyl]- [ACD/Index Name]
(3-(2-Hydroxypropan-2-yl)pyridin-2-yl)boronicacid
[1310384-99-6] [RN]
[3-(2-hydroxypropan-2-yl)pyridin-2-yl]boronic acid
3-(2-HYDROXYPROPAN-2-YL)PYRIDIN-2-YLBORONIC ACID
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.2±0.1 g/cm3
Boiling Point: 401.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.8±3.0 kJ/mol
Flash Point: 196.5±31.5 °C
Index of Refraction: 1.545
Molar Refractivity: 46.5±0.4 cm3
#H bond acceptors: 4
#H bond donors: 3
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -0.39
ACD/LogD (pH 5.5): 0.13
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 27.47
ACD/LogD (pH 7.4): -0.26
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 11.34
Polar Surface Area: 74 Å2
Polarizability: 18.4±0.5 10-24cm3
Surface Tension: 54.2±5.0 dyne/cm
Molar Volume: 147.0±5.0 cm3

Click to predict properties on the Chemicalize site


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