ChemSpider 2D Image | 5b,8,8,11a,13a-Pentamethyl-3-oxo-1,3,5,5a,5b,6,7,7a,8,9,10,11,11a,11b,12,13,13a,13b-octadecahydrochryseno[1,2-c]furan-1-yl acetate | C27H40O4

5b,8,8,11a,13a-Pentamethyl-3-oxo-1,3,5,5a,5b,6,7,7a,8,9,10,11,11a,11b,12,13,13a,13b-octadecahydrochryseno[1,2-c]furan-1-yl acetate

  • Molecular FormulaC27H40O4
  • Average mass428.604 Da
  • Monoisotopic mass428.292664 Da
  • ChemSpider ID21433384

More details:

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

5b,8,8,11a,13a-Pentamethyl-3-oxo-1,3,5,5a,5b,6,7,7a,8,9,10,11,11a,11b,12,13,13a,13b-octadecahydrochryseno[1,2-c]furan-1-yl acetate [ACD/IUPAC Name]
5b,8,8,11a,13a-Pentamethyl-3-oxo-1,3,5,5a,5b,6,7,7a,8,9,10,11,11a,11b,12,13,13a,13b-octadecahydrochryseno[1,2-c]furan-1-yl-acetat [German] [ACD/IUPAC Name]
Acétate de 5b,8,8,11a,13a-pentaméthyl-3-oxo-1,3,5,5a,5b,6,7,7a,8,9,10,11,11a,11b,12,13,13a,13b-octadécahydrochryséno[1,2-c]furan-1-yle [French] [ACD/IUPAC Name]
Chryseno[1,2-c]furan-3(1H)-one, 1-(acetyloxy)-5,5a,5b,6,7,7a,8,9,10,11,11a,11b,12,13,13a,13b-hexadecahydro-5b,8,8,11a,13a-pentamethyl- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 528.2±43.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 80.3±3.0 kJ/mol
Flash Point: 258.2±26.6 °C
Index of Refraction: 1.544
Molar Refractivity: 120.2±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: 7.63
ACD/LogD (pH 5.5): 7.08
ACD/BCF (pH 5.5): 141482.11
ACD/KOC (pH 5.5): 169219.08
ACD/LogD (pH 7.4): 7.08
ACD/BCF (pH 7.4): 141482.11
ACD/KOC (pH 7.4): 169219.08
Polar Surface Area: 53 Å2
Polarizability: 47.6±0.5 10-24cm3
Surface Tension: 42.9±5.0 dyne/cm
Molar Volume: 380.6±5.0 cm3

Click to predict properties on the Chemicalize site


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