ChemSpider 2D Image | 3,1'-dihydroxy-gamma-carotene | C40H58O2

3,1'-dihydroxy-γ-carotene

  • Molecular FormulaC40H58O2
  • Average mass570.887 Da
  • Monoisotopic mass570.443665 Da
  • ChemSpider ID17220954

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3R)-1',2'-Dihydro-β,ψ-carotene-1',3-diol [ACD/IUPAC Name]
(3R)-1',2'-Dihydro-β,ψ-carotène-1',3-diol [French] [ACD/IUPAC Name]
(3R)-1',2'-Dihydro-β,ψ-carotin-1',3-diol [German] [ACD/IUPAC Name]
3,1'-dihydroxy-γ-carotene
β,ψ-Carotene-1',3-diol, 1',2'-dihydro-, (3R)- [ACD/Index Name]
1',3-dihydroxy-γ-carotene
3,1'-(OH)2-γ-carotene

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

Density: 1.0±0.1 g/cm3
Boiling Point: 715.2±53.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.2 mmHg at 25°C
Enthalpy of Vaporization: 119.4±6.0 kJ/mol
Flash Point: 272.6±25.5 °C
Index of Refraction: 1.558
Molar Refractivity: 189.6±0.3 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 2
ACD/LogP: 11.83
ACD/LogD (pH 5.5): 10.69
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 10.69
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 40 Å2
Polarizability: 75.2±0.5 10-24cm3
Surface Tension: 38.5±3.0 dyne/cm
Molar Volume: 588.3±3.0 cm3

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