Found 70 results

Search term: MF = 'C_{6}H_{9}FO_{4}'
ChemSpider 2D Image | (1R,2R,3S,4S)-5-Fluoro-5-cyclohexene-1,2,3,4-tetrol | C6H9FO4

(1R,2R,3S,4S)-5-Fluoro-5-cyclohexene-1,2,3,4-tetrol

  • Molecular FormulaC6H9FO4
  • Average mass164.132 Da
  • Monoisotopic mass164.048492 Da
  • ChemSpider ID29337059

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

(1R,2R,3S,4S)-5-Fluor-5-cyclohexen-1,2,3,4-tetrol [German] [ACD/IUPAC Name]
(1R,2R,3S,4S)-5-Fluoro-5-cyclohexene-1,2,3,4-tetrol [ACD/IUPAC Name]
(1R,2R,3S,4S)-5-Fluoro-5-cyclohexène-1,2,3,4-tétrol [French] [ACD/IUPAC Name]
5-Cyclohexene-1,2,3,4-tetrol, 5-fluoro-, (1R,2R,3S,4S)- [ACD/Index Name]
(1R,2R,3S,4S)-5-Fluoro-5-cyclohexene-1,2,3,4-tetraol
900791-63-1 [RN]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 292.5±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 61.7±6.0 kJ/mol
Flash Point: 130.7±27.3 °C
Index of Refraction: 1.583
Molar Refractivity: 33.6±0.4 cm3
#H bond acceptors: 4
#H bond donors: 4
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 0.13
ACD/LogD (pH 5.5): -0.95
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 7.21
ACD/LogD (pH 7.4): -0.95
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 7.21
Polar Surface Area: 81 Å2
Polarizability: 13.3±0.5 10-24cm3
Surface Tension: 72.5±5.0 dyne/cm
Molar Volume: 100.6±5.0 cm3

Click to predict properties on the Chemicalize site


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