ChemSpider 2D Image | 4,5-Didehydro-5,6,7,8,13',14'-hexahydro-beta,beta-carotene | C40H60

4,5-Didehydro-5,6,7,8,13',14'-hexahydro-β,β-carotene

  • Molecular FormulaC40H60
  • Average mass540.904 Da
  • Monoisotopic mass540.469482 Da
  • ChemSpider ID4484102

  • Double-bond stereo - Double-bond stereo

More details:

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

4,5-Didehydro-5,6,7,8,13',14'-hexahydro-β,β-carotene [ACD/IUPAC Name]
4,5-Didéhydro-5,6,7,8,13',14'-hexahydro-β,β-carotène [French] [ACD/IUPAC Name]
4,5-Didehydro-5,6,7,8,13',14'-hexahydro-β,β-carotin [German] [ACD/IUPAC Name]
β,β-Carotene, 4,5-didehydro-5,6,7,8,13',14'-hexahydro- [ACD/Index Name]
BCR
β-Carotene [Wiki]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 626.5±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 89.3±0.8 kJ/mol
Flash Point: 333.2±18.0 °C
Index of Refraction: 1.529
Molar Refractivity: 184.2±0.3 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: 16.13
ACD/LogD (pH 5.5): 13.92
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 13.92
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 0 Å2
Polarizability: 73.0±0.5 10-24cm3
Surface Tension: 32.7±3.0 dyne/cm
Molar Volume: 597.3±3.0 cm3

Click to predict properties on the Chemicalize site


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