ChemSpider 2D Image | (3R)-3-Fluoro-3-(trifluoromethyl)-2,2-oxiranediol | C3H2F4O3

(3R)-3-Fluoro-3-(trifluoromethyl)-2,2-oxiranediol

  • Molecular FormulaC3H2F4O3
  • Average mass162.040 Da
  • Monoisotopic mass161.994003 Da
  • ChemSpider ID24204459

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3R)-3-Fluor-3-(trifluormethyl)-2,2-oxirandiol [German] [ACD/IUPAC Name]
(3R)-3-Fluoro-3-(trifluoromethyl)-2,2-oxiranediol [ACD/IUPAC Name]
(3R)-3-Fluoro-3-(trifluorométhyl)-2,2-oxiranediol [French] [ACD/IUPAC Name]
2,2-Oxiranediol, 3-fluoro-3-(trifluoromethyl)-, (3R)- [ACD/Index Name]
(R)-3-fluoro-3-(trifluoromethyl)oxirane-2,2-diol
2,2-Oxiranediol, 3-fluoro-3-(trifluoromethyl)-, (3R)- (9CI)
232260-61-6 [RN]

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

Density: 1.9±0.1 g/cm3
Boiling Point: 184.6±40.0 °C at 760 mmHg
Vapour Pressure: 0.2±0.8 mmHg at 25°C
Enthalpy of Vaporization: 49.0±6.0 kJ/mol
Flash Point: 93.7±23.8 °C
Index of Refraction: 1.376
Molar Refractivity: 19.2±0.4 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.39
ACD/LogD (pH 5.5): 0.93
ACD/BCF (pH 5.5): 2.98
ACD/KOC (pH 5.5): 75.98
ACD/LogD (pH 7.4): 0.91
ACD/BCF (pH 7.4): 2.85
ACD/KOC (pH 7.4): 72.65
Polar Surface Area: 53 Å2
Polarizability: 7.6±0.5 10-24cm3
Surface Tension: 32.9±5.0 dyne/cm
Molar Volume: 83.6±5.0 cm3

Click to predict properties on the Chemicalize site


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