ChemSpider 2D Image | (3beta)-Cholest-5-en-3-yl octylcarbamate | C36H63NO2

(3β)-Cholest-5-en-3-yl octylcarbamate

  • Molecular FormulaC36H63NO2
  • Average mass541.891 Da
  • Monoisotopic mass541.485901 Da
  • ChemSpider ID4955826
  • defined stereocentres - 8 of 8 defined stereocentres


More details:






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

(3β)-Cholest-5-en-3-yl octylcarbamate [ACD/IUPAC Name]
(3β)-Cholest-5-en-3-yl-octylcarbamat [German] [ACD/IUPAC Name]
Carbamic acid, N-octyl-, (3β)-cholest-5-en-3-yl ester [ACD/Index Name]
Octylcarbamate de (3β)-cholest-5-én-3-yle [French] [ACD/IUPAC Name]
(1S,2R,5S,10S,11S,14R,15R)-2,15-DIMETHYL-14-[(2R)-6-METHYLHEPTAN-2-YL]TETRACYCLO[8.7.0.0ì,?.0––,–?]HEPTADEC-7-EN-5-YL N-OCTYLCARBAMATE
3-Cnoc
57228-66-7 [RN]
Cholest-5-en-3-ol (3β)-, octylcarbamate

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.0±0.1 g/cm3
Boiling Point: 611.3±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 90.8±3.0 kJ/mol
Flash Point: 323.5±23.2 °C
Index of Refraction: 1.515
Molar Refractivity: 165.6±0.4 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 2
ACD/LogP: 14.20
ACD/LogD (pH 5.5): 12.76
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 12.76
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 38 Å2
Polarizability: 65.7±0.5 10-24cm3
Surface Tension: 38.7±5.0 dyne/cm
Molar Volume: 549.3±5.0 cm3

Click to predict properties on the Chemicalize site






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