ChemSpider 2D Image | (3'E)-3',4'-Didehydro-1,2-dihydro-psi,psi-caroten-1-ol | C40H56O

(3'E)-3',4'-Didehydro-1,2-dihydro-ψ,ψ-caroten-1-ol

  • Molecular FormulaC40H56O
  • Average mass552.872 Da
  • Monoisotopic mass552.433105 Da
  • ChemSpider ID17220953

  • Double-bond stereo - Double-bond stereo

More details:

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

(3'E)-3',4'-Didehydro-1,2-dihydro-ψ,ψ-caroten-1-ol [ACD/IUPAC Name]
(3'E)-3',4'-Didéhydro-1,2-dihydro-ψ,ψ-carotén-1-ol [French] [ACD/IUPAC Name]
(3'E)-3',4'-Didehydro-1,2-dihydro-ψ,ψ-carotin-1-ol [German] [ACD/IUPAC Name]
ψ,ψ-Caroten-1-ol, 3',4'-didehydro-1,2-dihydro-, (3'E)- [ACD/Index Name]
1'-Hydroxy-3,4-didehydrolycopene
1-OH-3',4'-Didehydrolycopene
3',4'-Dehydrorhodopin
3',4'-Didehydro-1,2-dihydro-ψ,ψ-caroten-1-ol

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

Density: 0.9±0.1 g/cm3
Boiling Point: 702.1±39.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.0 mmHg at 25°C
Enthalpy of Vaporization: 117.5±6.0 kJ/mol
Flash Point: 174.0±23.3 °C
Index of Refraction: 1.539
Molar Refractivity: 188.5±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 2
ACD/LogP: 13.11
ACD/LogD (pH 5.5): 11.41
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 11.41
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 20 Å2
Polarizability: 74.7±0.5 10-24cm3
Surface Tension: 33.0±3.0 dyne/cm
Molar Volume: 602.0±3.0 cm3

Click to predict properties on the Chemicalize site


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