ChemSpider 2D Image | (3beta)-(26,26,26,27,27,27-~2~H_6_)-24,25-Epoxycholest-5-en-3-ol | C27H38D6O2

(3β)-(26,26,26,27,27,27-2H6)-24,25-Epoxycholest-5-en-3-ol

  • Molecular FormulaC27H38D6O2
  • Average mass406.674 Da
  • Monoisotopic mass406.371796 Da
  • ChemSpider ID7826148

  • defined stereocentres - 8 of 9 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

(3β)-(26,26,26,27,27,27-2H6)-24,25-Epoxycholest-5-en-3-ol [ACD/IUPAC Name]
(3β)-(26,26,26,27,27,27-2H6)-24,25-Epoxycholest-5-en-3-ol [German] [ACD/IUPAC Name]
(3β)-(26,26,26,27,27,27-2H6)-24,25-Époxycholest-5-én-3-ol [French] [ACD/IUPAC Name]
Cholest-5-en-26,26,26,27,27,27-d6-3-ol, 24,25-epoxy-, (3β)- [ACD/Index Name]
(3?)?-24,?25-?epoxy-?holest-?5-?en-?26,?26,?26,?27,?27,?27-?d6-?3-?ol
1246302-86-2 [RN]
24,25-epoxy-cholest-5-en-3β-ol(d6)
24,25-epoxy-cholesterol(d6)
MFCD22416728

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

LMST01010091 [DBID]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 496.4±18.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 88.0±6.0 kJ/mol
Flash Point: 201.2±15.5 °C
Index of Refraction: 1.544
Molar Refractivity: 119.7±0.4 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 7.34
ACD/LogD (pH 5.5): 6.66
ACD/BCF (pH 5.5): 67868.15
ACD/KOC (pH 5.5): 100020.09
ACD/LogD (pH 7.4): 6.66
ACD/BCF (pH 7.4): 67868.15
ACD/KOC (pH 7.4): 100020.09
Polar Surface Area: 33 Å2
Polarizability: 47.4±0.5 10-24cm3
Surface Tension: 41.2±5.0 dyne/cm
Molar Volume: 379.1±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement