ChemSpider 2D Image | 3,4-Dihydrospirilloxanthin | C42H62O2

3,4-Dihydrospirilloxanthin

  • Molecular FormulaC42H62O2
  • Average mass598.940 Da
  • Monoisotopic mass598.474976 Da
  • ChemSpider ID17220952

  • Double-bond stereo - Double-bond stereo

More details:

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

(3E)-1,1'-Dimethoxy-3,4-didehydro-1,1',2,2'-tetrahydro-ψ,ψ-carotene [ACD/IUPAC Name]
(3E)-1,1'-Diméthoxy-3,4-didéhydro-1,1',2,2'-tétrahydro-ψ,ψ-carotène [French] [ACD/IUPAC Name]
(3E)-1,1'-Dimethoxy-3,4-didehydro-1,1',2,2'-tetrahydro-ψ,ψ-carotin [German] [ACD/IUPAC Name]
3,4-Dihydrospirilloxanthin
ψ,ψ-Carotene, 3,4-didehydro-1,1',2,2'-tetrahydro-1,1'-dimethoxy-, (3E)- [ACD/Index Name]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 699.7±48.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 98.8±3.0 kJ/mol
Flash Point: 155.4±25.3 °C
Index of Refraction: 1.520
Molar Refractivity: 199.8±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 19
#Rule of 5 Violations: 2
ACD/LogP: 12.71
ACD/LogD (pH 5.5): 11.33
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 11.33
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 18 Å2
Polarizability: 79.2±0.5 10-24cm3
Surface Tension: 31.5±3.0 dyne/cm
Molar Volume: 656.8±3.0 cm3

Click to predict properties on the Chemicalize site


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