ChemSpider 2D Image | 3-(6-Chloro-5-fluoro-4-pyrimidinyl)-2-(2,4-difluorophenyl)-2-butanol | C14H12ClF3N2O

3-(6-Chloro-5-fluoro-4-pyrimidinyl)-2-(2,4-difluorophenyl)-2-butanol

  • Molecular FormulaC14H12ClF3N2O
  • Average mass316.706 Da
  • Monoisotopic mass316.059021 Da
  • ChemSpider ID38772845

More details:

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

3-(6-Chlor-5-fluor-4-pyrimidinyl)-2-(2,4-difluorphenyl)-2-butanol [German] [ACD/IUPAC Name]
3-(6-Chloro-5-fluoro-4-pyrimidinyl)-2-(2,4-difluorophenyl)-2-butanol [ACD/IUPAC Name]
3-(6-Chloro-5-fluoro-4-pyrimidinyl)-2-(2,4-difluorophényl)-2-butanol [French] [ACD/IUPAC Name]
4-Pyrimidineethanol, 6-chloro-α-(2,4-difluorophenyl)-5-fluoro-α,β-dimethyl- [ACD/Index Name]
188416-35-5 [RN]
3-(6-Chloro-5-fluoropyrimidin-4-yl)-2-(2,4-difluorophenyl)butan-2-ol

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

Density: 1.4±0.1 g/cm3
Boiling Point: 375.2±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 65.7±3.0 kJ/mol
Flash Point: 180.7±26.5 °C
Index of Refraction: 1.547
Molar Refractivity: 71.7±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.53
ACD/LogD (pH 5.5): 2.61
ACD/BCF (pH 5.5): 56.91
ACD/KOC (pH 5.5): 628.06
ACD/LogD (pH 7.4): 2.61
ACD/BCF (pH 7.4): 56.91
ACD/KOC (pH 7.4): 628.06
Polar Surface Area: 46 Å2
Polarizability: 28.4±0.5 10-24cm3
Surface Tension: 45.9±3.0 dyne/cm
Molar Volume: 226.1±3.0 cm3

Click to predict properties on the Chemicalize site


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