Found 54 results

Search term: MF = 'C_{33}H_{56}O_{3}'
ChemSpider 2D Image | (3beta,8alpha,9beta,20S)-Cholest-5-en-3-yl 3-methylbutyl carbonate | C33H56O3

(3β,8α,9β,20S)-Cholest-5-en-3-yl 3-methylbutyl carbonate

  • Molecular FormulaC33H56O3
  • Average mass500.796 Da
  • Monoisotopic mass500.422943 Da
  • ChemSpider ID10060130

  • defined stereocentres - 8 of 8 defined stereocentres

More details:

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

(3β,8α,9β,20S)-Cholest-5-en-3-yl 3-methylbutyl carbonate [ACD/IUPAC Name]
(3β,8α,9β,20S)-Cholest-5-en-3-yl-3-methylbutylcarbonat [German] [ACD/IUPAC Name]
Carbonate de (3β,8α,9β,20S)-cholest-5-én-3-yle et de 3-méthylbutyle [French] [ACD/IUPAC Name]
Carbonic acid, (3β,8α,9β,20S)-cholest-5-en-3-yl 3-methylbutyl ester [ACD/Index Name]

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

ZINC04258081 [DBID]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 569.7±20.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 85.5±3.0 kJ/mol
Flash Point: 141.2±15.9 °C
Index of Refraction: 1.511
Molar Refractivity: 149.8±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 12.68
ACD/LogD (pH 5.5): 10.83
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 10.83
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 36 Å2
Polarizability: 59.4±0.5 10-24cm3
Surface Tension: 37.8±5.0 dyne/cm
Molar Volume: 500.2±5.0 cm3

Click to predict properties on the Chemicalize site


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