Found 54 results

Search term: MF = 'C_{33}H_{56}O_{3}'
ChemSpider 2D Image | (3S,10R,13R)-10,13-Dimethyl-17-octyl-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl 2-methylbutyl carbonate | C33H56O3

(3S,10R,13R)-10,13-Dimethyl-17-octyl-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl 2-methylbutyl carbonate

  • Molecular FormulaC33H56O3
  • Average mass500.796 Da
  • Monoisotopic mass500.422943 Da
  • ChemSpider ID17461085

  • defined stereocentres - 3 of 8 defined stereocentres

More details:

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

(3S,10R,13R)-10,13-Dimethyl-17-octyl-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl 2-methylbutyl carbonate [ACD/IUPAC Name]
(3S,10R,13R)-10,13-Dimethyl-17-octyl-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl-2-methylbutylcarbonat [German] [ACD/IUPAC Name]
Carbonate de (3S,10R,13R)-10,13-diméthyl-17-octyl-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tétradécahydro-1H-cyclopenta[a]phénanthrén-3-yle et de 2-méthylbutyle [French] [ACD/IUPAC Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 576.8±20.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 86.4±3.0 kJ/mol
Flash Point: 144.4±15.9 °C
Index of Refraction: 1.512
Molar Refractivity: 149.8±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 2
ACD/LogP: 13.05
ACD/LogD (pH 5.5): 11.56
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 11.56
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: 38.7±5.0 dyne/cm
Molar Volume: 499.0±5.0 cm3

Click to predict properties on the Chemicalize site


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