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Search term: synechoxanthin (Found by synonym)

ChemSpider 2D Image | chi,chi-Carotene-18,18'-dioic acid | C40H44O4

chi,chi-Carotene-18,18'-dioic acid

  • Molecular FormulaC40H44O4
  • Average mass588.775 Da
  • Monoisotopic mass588.323975 Da
  • ChemSpider ID28285568
  • Double-bond stereo - Double-bond stereo


More details:



Featured data source



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

Acide chi,chi-carotène-18,18'-dioïque [French] [ACD/IUPAC Name]
chi,chi-Carotene-18,18'-dioic acid [ACD/Index Name] [ACD/IUPAC Name]
chi,chi-Carotin-18,18'-disäure [German] [ACD/IUPAC Name]
synechoxanthin

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.1±0.1 g/cm3
Boiling Point: 794.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 121.1±3.0 kJ/mol
Flash Point: 448.1±29.4 °C
Index of Refraction: 1.617
Molar Refractivity: 189.3±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: 11.45
ACD/LogD (pH 5.5): 7.71
ACD/BCF (pH 5.5): 97383.70
ACD/KOC (pH 5.5): 22564.71
ACD/LogD (pH 7.4): 6.24
ACD/BCF (pH 7.4): 3276.58
ACD/KOC (pH 7.4): 759.22
Polar Surface Area: 75 Å2
Polarizability: 75.0±0.5 10-24cm3
Surface Tension: 44.2±3.0 dyne/cm
Molar Volume: 541.1±3.0 cm3

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