ChemSpider 2D Image | (4-{[(2,2-Dimethylpropyl)amino]methyl}phenyl)boronic acid | C12H20BNO2

(4-{[(2,2-Dimethylpropyl)amino]methyl}phenyl)boronic acid

  • Molecular FormulaC12H20BNO2
  • Average mass221.104 Da
  • Monoisotopic mass221.158707 Da
  • ChemSpider ID61007623

More details:

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

(4-{[(2,2-Dimethylpropyl)amino]methyl}phenyl)boronic acid [ACD/IUPAC Name]
(4-{[(2,2-Dimethylpropyl)amino]methyl}phenyl)borsäure [German] [ACD/IUPAC Name]
Acide (4-{[(2,2-diméthylpropyl)amino]méthyl}phényl)boronique [French] [ACD/IUPAC Name]
Boronic acid, B-[4-[[(2,2-dimethylpropyl)amino]methyl]phenyl]- [ACD/Index Name]
1266375-98-7 [RN]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 355.5±44.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 63.4±3.0 kJ/mol
Flash Point: 168.8±28.4 °C
Index of Refraction: 1.518
Molar Refractivity: 64.7±0.4 cm3
#H bond acceptors: 3
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.65
ACD/LogD (pH 5.5): -0.53
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.54
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 5.93
Polar Surface Area: 52 Å2
Polarizability: 25.7±0.5 10-24cm3
Surface Tension: 39.4±5.0 dyne/cm
Molar Volume: 213.5±5.0 cm3

Click to predict properties on the Chemicalize site


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