ChemSpider 2D Image | (5-chloro-2-isobutoxy-3-pyridyl)boronic acid | C9H13BClNO3

(5-chloro-2-isobutoxy-3-pyridyl)boronic acid

  • Molecular FormulaC9H13BClNO3
  • Average mass229.468 Da
  • Monoisotopic mass229.067703 Da
  • ChemSpider ID28294200

More details:






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

(5-Chlor-2-isobutoxy-3-pyridinyl)borsäure [German] [ACD/IUPAC Name]
Acide (5-chloro-2-isobutoxy-3-pyridinyl)boronique [French] [ACD/IUPAC Name]
(5-Chloro-2-isobutoxy-3-pyridinyl)boronic acid [ACD/IUPAC Name]
(5-Chloro-2-isobutoxypyridin-3-yl)boronic acid
(5-Chloro-2-isobutoxypyridin-3-yl)boronicacid
(5-Chloro-2-propoxypyridin-3-yl)boronic acid
[1217501-42-2]
[5-chloro-2-(2-methylpropoxy)pyridin-3-yl]boronic acid
1150561-67-3 [RN]
1217501-42-2 [RN]
More...

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 373.5±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 65.5±3.0 kJ/mol
Flash Point: 179.7±30.7 °C
Index of Refraction: 1.524
Molar Refractivity: 56.1±0.4 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.04
ACD/LogD (pH 5.5): 1.82
ACD/BCF (pH 5.5): 10.71
ACD/KOC (pH 5.5): 134.64
ACD/LogD (pH 7.4): 0.08
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.43
Polar Surface Area: 63 Å2
Polarizability: 22.3±0.5 10-24cm3
Surface Tension: 47.4±5.0 dyne/cm
Molar Volume: 183.4±5.0 cm3

Click to predict properties on the Chemicalize site






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