ChemSpider 2D Image | (3beta,7alpha)-7-Hydroxycholest-5-en-3-yl 2,3-dideoxy-alpha-D-erythro-hex-2-enopyranoside | C33H54O5

(3β,7α)-7-Hydroxycholest-5-en-3-yl 2,3-dideoxy-α-D-erythro-hex-2-enopyranoside

  • Molecular FormulaC33H54O5
  • Average mass530.779 Da
  • Monoisotopic mass530.397095 Da
  • ChemSpider ID9082814

  • defined stereocentres - 12 of 12 defined stereocentres

More details:

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

(3β,7α)-7-Hydroxycholest-5-en-3-yl 2,3-dideoxy-α-D-erythro-hex-2-enopyranoside [ACD/IUPAC Name]
(3β,7α)-7-Hydroxycholest-5-en-3-yl-2,3-didesoxy-α-D-erythro-hex-2-enopyranosid [German] [ACD/IUPAC Name]
2,3-Didésoxy-α-D-érythro-hex-2-énopyranoside de (3β,7α)-7-hydroxycholest-5-én-3-yle [French] [ACD/IUPAC Name]
α-D-erythro-Hex-2-enopyranoside, (3β,7α)-7-hydroxycholest-5-en-3-yl 2,3-dideoxy- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 650.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.4 mmHg at 25°C
Enthalpy of Vaporization: 109.7±6.0 kJ/mol
Flash Point: 346.9±31.5 °C
Index of Refraction: 1.558
Molar Refractivity: 152.1±0.4 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 7.96
ACD/LogD (pH 5.5): 6.45
ACD/BCF (pH 5.5): 47221.99
ACD/KOC (pH 5.5): 77149.80
ACD/LogD (pH 7.4): 6.45
ACD/BCF (pH 7.4): 47221.94
ACD/KOC (pH 7.4): 77149.72
Polar Surface Area: 79 Å2
Polarizability: 60.3±0.5 10-24cm3
Surface Tension: 47.5±5.0 dyne/cm
Molar Volume: 471.5±5.0 cm3

Click to predict properties on the Chemicalize site


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