ChemSpider 2D Image | 4,5-Didehydro-5,6-dihydro-beta,psi-caroten-3-ol | C40H56O

4,5-Didehydro-5,6-dihydro-β,ψ-caroten-3-ol

  • Molecular FormulaC40H56O
  • Average mass552.872 Da
  • Monoisotopic mass552.433105 Da
  • ChemSpider ID35013230

  • Double-bond stereo - Double-bond stereo

More details:

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

4,5-Didehydro-5,6-dihydro-β,ψ-caroten-3-ol [ACD/IUPAC Name]
4,5-Didéhydro-5,6-dihydro-β,ψ-carotén-3-ol [French] [ACD/IUPAC Name]
4,5-Didehydro-5,6-dihydro-β,ψ-carotin-3-ol [German] [ACD/IUPAC Name]
β,ψ-Caroten-3-ol, 4,5-didehydro-5,6-dihydro- [ACD/Index Name]
3-Hydroxy-a-zeacarotene
3-Hydroxy-δ-carotene
4-[(1E,3E,5E,7E,9E,11E,13E,15E,17E,19E)-3,7,12,16,20,24-hexamethylpentacosa-1,3,5,7,9,11,13,15,17,19,23-undecaen-1-yl]-3,5,5-trimethylcyclohex-2-en-1-ol
75324-12-8 [RN]
e,y-Caroten-3-ol
Monol 487
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

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

Density: 0.9±0.1 g/cm3
Boiling Point: 676.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.7 mmHg at 25°C
Enthalpy of Vaporization: 113.7±6.0 kJ/mol
Flash Point: 293.0±23.7 °C
Index of Refraction: 1.554
Molar Refractivity: 188.0±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 2
ACD/LogP: 13.45
ACD/LogD (pH 5.5): 11.82
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 11.82
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 20 Å2
Polarizability: 74.5±0.5 10-24cm3
Surface Tension: 36.2±3.0 dyne/cm
Molar Volume: 586.2±3.0 cm3

Click to predict properties on the Chemicalize site


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