ChemSpider 2D Image | (6'Z,8'E,10E,10'E,12E,12'E,14E,14'E)-3,4,4',5'-Tetradehydro-5',9-dihydro-beta,beta-caroten-9-ol | C40H54O

(6'Z,8'E,10E,10'E,12E,12'E,14E,14'E)-3,4,4',5'-Tetradehydro-5',9-dihydro-β,β-caroten-9-ol

  • Molecular FormulaC40H54O
  • Average mass550.856 Da
  • Monoisotopic mass550.417480 Da
  • ChemSpider ID9424864

  • Double-bond stereo - Double-bond stereo

More details:

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

(6'Z,8'E,10E,10'E,12E,12'E,14E,14'E)-3,4,4',5'-Tetradehydro-5',9-dihydro-β,β-caroten-9-ol [ACD/IUPAC Name]
(6'Z,8'E,10E,10'E,12E,12'E,14E,14'E)-3,4,4',5'-Tétradéhydro-5',9-dihydro-β,β-carotén-9-ol [French] [ACD/IUPAC Name]
(6'Z,8'E,10E,10'E,12E,12'E,14E,14'E)-3,4,4',5'-Tetradehydro-5',9-dihydro-β,β-carotin-9-ol [German] [ACD/IUPAC Name]
β,β-Caroten-9-ol, 3,4,4',5'-tetradehydro-5',9-dihydro-, (6'Z,8'E,10E,10'E,12E,12'E,14E,14'E)- [ACD/Index Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 681.5±24.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.8 mmHg at 25°C
Enthalpy of Vaporization: 114.4±6.0 kJ/mol
Flash Point: 172.2±19.2 °C
Index of Refraction: 1.581
Molar Refractivity: 187.0±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 13.37
ACD/LogD (pH 5.5): 11.39
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 11.39
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 20 Å2
Polarizability: 74.1±0.5 10-24cm3
Surface Tension: 39.3±3.0 dyne/cm
Molar Volume: 561.0±3.0 cm3

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