ChemSpider 2D Image | (3-Chloro-2-fluoro-4-methylphenyl)boronic acid | C7H7BClFO2

(3-Chloro-2-fluoro-4-methylphenyl)boronic acid

  • Molecular FormulaC7H7BClFO2
  • Average mass188.392 Da
  • Monoisotopic mass188.021164 Da
  • ChemSpider ID71046541

More details:

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

(3-Chlor-2-fluor-4-methylphenyl)borsäure [German] [ACD/IUPAC Name]
(3-Chloro-2-fluoro-4-methylphenyl)boronic acid [ACD/IUPAC Name]
Acide (3-chloro-2-fluoro-4-méthylphényl)boronique [French] [ACD/IUPAC Name]
Boronic acid, B-(3-chloro-2-fluoro-4-methylphenyl)- [ACD/Index Name]
2377608-77-8 [RN]
MFCD23712893

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

Density: 1.4±0.1 g/cm3
Boiling Point: 322.2±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 59.5±3.0 kJ/mol
Flash Point: 148.7±30.7 °C
Index of Refraction: 1.528
Molar Refractivity: 42.9±0.4 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.81
ACD/LogD (pH 5.5): 2.52
ACD/BCF (pH 5.5): 48.67
ACD/KOC (pH 5.5): 560.29
ACD/LogD (pH 7.4): 2.32
ACD/BCF (pH 7.4): 30.42
ACD/KOC (pH 7.4): 350.24
Polar Surface Area: 40 Å2
Polarizability: 17.0±0.5 10-24cm3
Surface Tension: 42.1±5.0 dyne/cm
Molar Volume: 139.2±5.0 cm3

Click to predict properties on the Chemicalize site


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