ChemSpider 2D Image | Cholesterol-3-d1 | C27H45DO

Cholesterol-3-d1

  • Molecular FormulaC27H45DO
  • Average mass387.660 Da
  • Monoisotopic mass387.361145 Da
  • ChemSpider ID32821220

  • defined stereocentres - 8 of 8 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

(3β)-(3-2H)Cholest-5-en-3-ol [ACD/IUPAC Name]
(3β)-(3-2H)Cholest-5-en-3-ol [German] [ACD/IUPAC Name]
(3β)-(3-2H)Cholest-5-én-3-ol [French] [ACD/IUPAC Name]
51467-57-3 [RN]
Cholest-5-en-3-d-3-ol, (3β)- [ACD/Index Name]
Cholesterol-3-d1
92543-08-3 [RN]
Cholesterol-2,2,3,4,4,6-d6
Cholesterol-d6

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

Density: 1.0±0.1 g/cm3
Boiling Point: 480.6±14.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 85.9±6.0 kJ/mol
Flash Point: 209.3±12.4 °C
Index of Refraction: 1.525
Molar Refractivity: 120.0±0.4 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 9.85
ACD/LogD (pH 5.5): 8.10
ACD/BCF (pH 5.5): 838380.06
ACD/KOC (pH 5.5): 604739.75
ACD/LogD (pH 7.4): 8.10
ACD/BCF (pH 7.4): 838380.06
ACD/KOC (pH 7.4): 604739.75
Polar Surface Area: 20 Å2
Polarizability: 47.6±0.5 10-24cm3
Surface Tension: 38.2±5.0 dyne/cm
Molar Volume: 391.4±5.0 cm3

Click to predict properties on the Chemicalize site


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