ChemSpider 2D Image | Hydroxyspheroidene | C41H62O2

Hydroxyspheroidene

  • Molecular FormulaC41H62O2
  • Average mass586.930 Da
  • Monoisotopic mass586.474976 Da
  • ChemSpider ID17220936

  • Double-bond stereo - Double-bond stereo

More details:

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

(3'E)-1'-Methoxy-3',4'-didehydro-1,1',2,2',7,8-hexahydro-ψ,ψ-caroten-1-ol [ACD/IUPAC Name]
(3'E)-1'-Méthoxy-3',4'-didéhydro-1,1',2,2',7,8-hexahydro-ψ,ψ-carotén-1-ol [French] [ACD/IUPAC Name]
(3'E)-1'-Methoxy-3',4'-didehydro-1,1',2,2',7,8-hexahydro-ψ,ψ-carotin-1-ol [German] [ACD/IUPAC Name]
1191-20-4 [RN]
1'-Methoxy-3',4'-didehydro-1,2,7,8,1',2'-hexahydro-ψ,ψ-caroten-1-ol
3,4-Didehydro-1,1',2,2',7',8'-hexahydro-1'-hydroxy-1-methoxy-ψ,ψ-carotene
Hydroxyspheroidene
ψ,ψ-Caroten-1-ol, 3',4'-didehydro-1,1',2,2',7,8-hexahydro-1'-methoxy-, (3'E)- [ACD/Index Name]
C15902
OH-Spheroidene

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

Density: 0.9±0.1 g/cm3
Boiling Point: 698.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.0 mmHg at 25°C
Enthalpy of Vaporization: 116.9±6.0 kJ/mol
Flash Point: 291.5±24.4 °C
Index of Refraction: 1.523
Molar Refractivity: 194.9±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 19
#Rule of 5 Violations: 2
ACD/LogP: 12.47
ACD/LogD (pH 5.5): 11.28
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 11.28
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 29 Å2
Polarizability: 77.3±0.5 10-24cm3
Surface Tension: 32.8±3.0 dyne/cm
Molar Volume: 637.8±3.0 cm3

Click to predict properties on the Chemicalize site


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