ChemSpider 2D Image | (3-Ethyl-3-hydroxyheptyl)boronic acid | C9H21BO3

(3-Ethyl-3-hydroxyheptyl)boronic acid

  • Molecular FormulaC9H21BO3
  • Average mass188.072 Da
  • Monoisotopic mass188.158371 Da
  • ChemSpider ID26266958

More details:

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

(3-Ethyl-3-hydroxyheptyl)boronic acid [ACD/IUPAC Name]
(3-Ethyl-3-hydroxyheptyl)borsäure [German] [ACD/IUPAC Name]
Acide (3-éthyl-3-hydroxyheptyl)boronique [French] [ACD/IUPAC Name]
Boronic acid, B-(3-ethyl-3-hydroxyheptyl)- [ACD/Index Name]
1498319-00-8 [RN]
MFCD06212408

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

Density: 1.0±0.1 g/cm3
Boiling Point: 334.9±44.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 67.0±6.0 kJ/mol
Flash Point: 156.3±28.4 °C
Index of Refraction: 1.453
Molar Refractivity: 51.7±0.3 cm3
#H bond acceptors: 3
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.25
ACD/LogD (pH 5.5): 2.17
ACD/BCF (pH 5.5): 26.18
ACD/KOC (pH 5.5): 360.25
ACD/LogD (pH 7.4): 2.17
ACD/BCF (pH 7.4): 26.16
ACD/KOC (pH 7.4): 359.96
Polar Surface Area: 61 Å2
Polarizability: 20.5±0.5 10-24cm3
Surface Tension: 37.0±3.0 dyne/cm
Molar Volume: 191.6±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement