ChemSpider 2D Image | 2,5-Anhydro-3,4-dideoxy-1-O-{[(5,6-dichloro-9a-ethyl-3-oxo-2,3,9,9a-tetrahydro-1H-fluoren-7-yl)oxy]acetyl}hexitol | C23H26Cl2O6

2,5-Anhydro-3,4-dideoxy-1-O-{[(5,6-dichloro-9a-ethyl-3-oxo-2,3,9,9a-tetrahydro-1H-fluoren-7-yl)oxy]acetyl}hexitol

  • Molecular FormulaC23H26Cl2O6
  • Average mass469.355 Da
  • Monoisotopic mass468.110657 Da
  • ChemSpider ID23237950

More details:

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

2,5-Anhydro-3,4-dideoxy-1-O-{[(5,6-dichloro-9a-ethyl-3-oxo-2,3,9,9a-tetrahydro-1H-fluoren-7-yl)oxy]acetyl}hexitol [ACD/IUPAC Name]
2,5-Anhydro-3,4-didesoxy-1-O-{[(5,6-dichlor-9a-ethyl-3-oxo-2,3,9,9a-tetrahydro-1H-fluoren-7-yl)oxy]acetyl}hexitol [German] [ACD/IUPAC Name]
2,5-Anhydro-3,4-didésoxy-1-O-{2-[(5,6-dichloro-9a-éthyl-3-oxo-2,3,9,9a-tétrahydro-1H-fluorén-7-yl)oxy]acétyl}hexitol [French] [ACD/IUPAC Name]
Hexitol, 2,5-anhydro-3,4-dideoxy-, 1-[2-[(5,6-dichloro-9a-ethyl-2,3,9,9a-tetrahydro-3-oxo-1H-fluoren-7-yl)oxy]acetate] [ACD/Index Name]
(3,4-Dichloro-8a-ethyl-6-oxo-7,8,8a,9-tetrahydro-6H-fluoren-2-yloxy)-acetic acid 5-hydroxymethyl-tetrahydro-furan-2-ylmethyl ester

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

Density: 1.4±0.1 g/cm3
Boiling Point: 625.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 97.3±3.0 kJ/mol
Flash Point: 331.9±31.5 °C
Index of Refraction: 1.603
Molar Refractivity: 115.6±0.4 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 3.39
ACD/LogD (pH 5.5): 3.92
ACD/BCF (pH 5.5): 562.87
ACD/KOC (pH 5.5): 3238.51
ACD/LogD (pH 7.4): 3.92
ACD/BCF (pH 7.4): 562.87
ACD/KOC (pH 7.4): 3238.51
Polar Surface Area: 82 Å2
Polarizability: 45.8±0.5 10-24cm3
Surface Tension: 58.8±5.0 dyne/cm
Molar Volume: 336.4±5.0 cm3

Click to predict properties on the Chemicalize site


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