Found 16 results

Search term: MF = 'C_{35}H_{51}NO_{4}'

ChemSpider 2D Image | (3beta,5beta,25S)-Spirostan-3-yl benzylcarbamate | C35H51NO4

(3β,5β,25S)-Spirostan-3-yl benzylcarbamate

  • Molecular FormulaC35H51NO4
  • Average mass549.784 Da
  • Monoisotopic mass549.381836 Da
  • ChemSpider ID76795784
  • defined stereocentres - 12 of 12 defined stereocentres


More details:






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

(3β,5β,25S)-Spirostan-3-yl benzylcarbamate [ACD/IUPAC Name]
(3β,5β,25S)-Spirostan-3-yl-benzylcarbamat [German] [ACD/IUPAC Name]
Benzylcarbamate de (3β,5β,25S)-spirostan-3-yle [French] [ACD/IUPAC Name]
Carbamic acid, N-(phenylmethyl)-, (3β,5β,25S)-spirostan-3-yl ester [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 650.6±38.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 95.9±3.0 kJ/mol
Flash Point: 347.3±26.8 °C
Index of Refraction: 1.574
Molar Refractivity: 157.6±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 2
ACD/LogP: 8.59
ACD/LogD (pH 5.5): 8.06
ACD/BCF (pH 5.5): 787983.75
ACD/KOC (pH 5.5): 578491.06
ACD/LogD (pH 7.4): 8.06
ACD/BCF (pH 7.4): 787979.44
ACD/KOC (pH 7.4): 578487.94
Polar Surface Area: 57 Å2
Polarizability: 62.5±0.5 10-24cm3
Surface Tension: 47.4±5.0 dyne/cm
Molar Volume: 477.8±5.0 cm3

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