ChemSpider 2D Image | (9cis,9'R,13R)-10',11'-Didehydro-7,8,9',11,12,12',13,14,15,15'-decahydro-beta,beta-carotene | C40H64

(9cis,9'R,13R)-10',11'-Didehydro-7,8,9',11,12,12',13,14,15,15'-decahydro-β,β-carotene

  • Molecular FormulaC40H64
  • Average mass544.936 Da
  • Monoisotopic mass544.500793 Da
  • ChemSpider ID61713200

  • Double-bond stereo - Double-bond stereo

More details:

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

(9cis,9'R,13R)-10',11'-Didehydro-7,8,9',11,12,12',13,14,15,15'-decahydro-β,β-carotene [ACD/IUPAC Name]
(9cis,9'R,13R)-10',11'-Didéhydro-7,8,9',11,12,12',13,14,15,15'-décahydro-β,β-carotène [French] [ACD/IUPAC Name]
(9cis,9'R,13R)-10',11'-Didehydro-7,8,9',11,12,12',13,14,15,15'-decahydro-β,β-carotin [German] [ACD/IUPAC Name]
β,β-Carotene, 10,11-didehydro-7',8',9,11',12,12',13',14',15,15'-decahydro-, (9R,9'cis,13'R)- [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: 587.7±29.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 84.5±0.8 kJ/mol
Flash Point: 319.1±18.4 °C
Index of Refraction: 1.514
Molar Refractivity: 182.1±0.3 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 2
ACD/LogP: 16.97
ACD/LogD (pH 5.5): 15.33
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 15.33
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 0 Å2
Polarizability: 72.2±0.5 10-24cm3
Surface Tension: 33.5±3.0 dyne/cm
Molar Volume: 604.7±3.0 cm3

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