Found 25 results

Search term: MF = 'C_{40}H_{54}O_{5}'
ChemSpider 2D Image | Gyroxanthin | C40H54O5

Gyroxanthin

  • Molecular FormulaC40H54O5
  • Average mass614.854 Da
  • Monoisotopic mass614.397095 Da
  • ChemSpider ID16737964

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 5 of 6 defined stereocentres

More details:

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

(3S,3'S,5R,5'R,6'R)-6,7,7',8'-Tetradehydro-5,5',6,6'-tetrahydro-5',6'-epoxy-β,β-carotene-3,3',5,19'-tetrol [ACD/IUPAC Name]
(3S,3'S,5R,5'R,6'R)-6,7,7',8'-Tétradéhydro-5,5',6,6'-tétrahydro-5',6'-époxy-β,β-carotène-3,3',5,19'-tétrol [French] [ACD/IUPAC Name]
(3S,3'S,5R,5'R,6'R)-6,7,7',8'-Tetradehydro-5,5',6,6'-tetrahydro-5',6'-epoxy-β,β-carotin-3,3',5,19'-tetrol [German] [ACD/IUPAC Name]
Gyroxanthin
β,β-Carotene-3,3',5,19'-tetrol, 6,7,7',8'-tetradehydro-5',6'-epoxy-5,5',6,6'-tetrahydro-, (3S,3'S,5R,5'R,6'R)- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 780.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±6.1 mmHg at 25°C
Enthalpy of Vaporization: 129.4±6.0 kJ/mol
Flash Point: 425.7±32.9 °C
Index of Refraction: 1.588
Molar Refractivity: 185.2±0.4 cm3
#H bond acceptors: 5
#H bond donors: 4
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 8.68
ACD/LogD (pH 5.5): 7.06
ACD/BCF (pH 5.5): 136856.30
ACD/KOC (pH 5.5): 165240.23
ACD/LogD (pH 7.4): 7.06
ACD/BCF (pH 7.4): 136856.30
ACD/KOC (pH 7.4): 165240.23
Polar Surface Area: 93 Å2
Polarizability: 73.4±0.5 10-24cm3
Surface Tension: 45.5±5.0 dyne/cm
Molar Volume: 550.7±5.0 cm3

Click to predict properties on the Chemicalize site


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