ChemSpider 2D Image | 1,6-Dichloro-1,6-dideoxy-beta-D-fructofuranosyl (6R)-3-deoxy-L-threo-hex-2-enodialdo-6,2-pyranoside | C12H16Cl2O8

1,6-Dichloro-1,6-dideoxy-β-D-fructofuranosyl (6R)-3-deoxy-L-threo-hex-2-enodialdo-6,2-pyranoside

  • Molecular FormulaC12H16Cl2O8
  • Average mass359.157 Da
  • Monoisotopic mass358.022217 Da
  • ChemSpider ID81368528

  • defined stereocentres - 7 of 7 defined stereocentres

More details:

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

(6R)-3-Désoxy-L-thréo-hex-2-énodialdo-6,2-pyranoside de 1,6-dichloro-1,6-didésoxy-β-D-fructofuranosyle [French] [ACD/IUPAC Name]
1,6-Dichloro-1,6-dideoxy-β-D-fructofuranosyl (6R)-3-deoxy-L-threo-hex-2-enodialdo-6,2-pyranoside [ACD/IUPAC Name]
L-threo-Hex-2-enodialdo-6,2-pyranoside, 1,6-dichloro-1,6-dideoxy-β-D-fructofuranosyl 3-deoxy-, (6R)- [ACD/Index Name]
105066-22-6 [RN]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 636.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.3 mmHg at 25°C
Enthalpy of Vaporization: 107.8±6.0 kJ/mol
Flash Point: 338.8±31.5 °C
Index of Refraction: 1.609
Molar Refractivity: 74.5±0.4 cm3
#H bond acceptors: 8
#H bond donors: 4
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 0.33
ACD/LogD (pH 5.5): -0.44
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 13.66
ACD/LogD (pH 7.4): -0.44
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 13.66
Polar Surface Area: 126 Å2
Polarizability: 29.5±0.5 10-24cm3
Surface Tension: 76.2±5.0 dyne/cm
Molar Volume: 215.1±5.0 cm3

Click to predict properties on the Chemicalize site


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