Found 98 results

Search term: MF = 'C_{31}H_{50}O_{6}'
ChemSpider 2D Image | (3beta,5alpha,6alpha,11alpha)-9,11-Dihydroxycholest-7-ene-3,6-diyl diacetate | C31H50O6

(3β,5α,6α,11α)-9,11-Dihydroxycholest-7-ene-3,6-diyl diacetate

  • Molecular FormulaC31H50O6
  • Average mass518.725 Da
  • Monoisotopic mass518.360718 Da
  • ChemSpider ID9267683

  • defined stereocentres - 10 of 10 defined stereocentres

More details:

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

(3β,5α,6α,11α)-9,11-Dihydroxycholest-7-en-3,6-diyl-diacetat [German] [ACD/IUPAC Name]
(3β,5α,6α,11α)-9,11-Dihydroxycholest-7-ene-3,6-diyl diacetate [ACD/IUPAC Name]
Cholest-7-ene-3,6,9,11-tetrol, 3,6-diacetate, (3β,5α,6α,11α)- [ACD/Index Name]
Diacétate de (3β,5α,6α,11α)-9,11-dihydroxycholest-7-ène-3,6-diyle [French] [ACD/IUPAC 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: 580.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.7 mmHg at 25°C
Enthalpy of Vaporization: 99.6±6.0 kJ/mol
Flash Point: 175.1±23.6 °C
Index of Refraction: 1.538
Molar Refractivity: 143.7±0.4 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 7.18
ACD/LogD (pH 5.5): 6.49
ACD/BCF (pH 5.5): 50737.09
ACD/KOC (pH 5.5): 81218.34
ACD/LogD (pH 7.4): 6.49
ACD/BCF (pH 7.4): 50737.04
ACD/KOC (pH 7.4): 81218.26
Polar Surface Area: 93 Å2
Polarizability: 57.0±0.5 10-24cm3
Surface Tension: 45.7±5.0 dyne/cm
Molar Volume: 459.7±5.0 cm3

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