ChemSpider 2D Image | all-trans-phytofluene | C40H62

all-trans-phytofluene

  • Molecular FormulaC40H62
  • Average mass542.920 Da
  • Monoisotopic mass542.485168 Da
  • ChemSpider ID4941340

  • Double-bond stereo - Double-bond stereo

More details:

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

all-trans-phytofluene
6NUO4W7YQ6
7,7',8,8',11,12-Hexahydro-y,y-carotene
7,7',8,8',11,12-Hexahydro-ψ,ψ-carotene [ACD/IUPAC Name]
7,7',8,8',11,12-Hexahydro-ψ,ψ-carotène [French] [ACD/IUPAC Name]
7,7',8,8',11,12-Hexahydro-ψ,ψ-carotin [German] [ACD/IUPAC Name]
phytofluene [Wiki]
PHYTOFLUENE, ALL-TRANS-
ψ,ψ-Carotene, 7,7',8,8',11,12-hexahydro- [ACD/Index Name]
(12E,14E)-2,6,10,14,19,23,27,31-octamethyldotriaconta-2,6,10,12,14,16,18,22,26,30-decaene
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

C05414 [DBID]
CHEBI:28129 [DBID]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 631.3±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 89.9±0.8 kJ/mol
Flash Point: 337.8±24.9 °C
Index of Refraction: 1.511
Molar Refractivity: 186.7±0.3 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 19
#Rule of 5 Violations: 2
ACD/LogP: 16.21
ACD/LogD (pH 5.5): 14.39
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 14.39
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 0 Å2
Polarizability: 74.0±0.5 10-24cm3
Surface Tension: 30.5±3.0 dyne/cm
Molar Volume: 623.4±3.0 cm3

Click to predict properties on the Chemicalize site


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