ChemSpider 2D Image | 3,3'-Dihydroxy(4,4'-~13~C_2_)-beta,beta-carotene-4,4'-dione | C3813C2H52O4


  • Molecular FormulaC3813C2H52O4
  • Average mass598.824 Da
  • Monoisotopic mass598.393250 Da
  • ChemSpider ID8968986
  • Double-bond stereo - Double-bond stereo

    Non-standard isotope - Non-standard isotope

More details:

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

3,3'-Dihydroxy(4,4'-13C2)-β,β-carotene-4,4'-dione [ACD/IUPAC Name]
3,3'-Dihydroxy(4,4'-13C2)-β,β-carotène-4,4'-dione [French] [ACD/IUPAC Name]
3,3'-Dihydroxy(4,4'-13C2)-β,β-carotin-4,4'-dion [German] [ACD/IUPAC Name]
β,β-Carotene-4,4'-dione-4,4'-13C2, 3,3'-dihydroxy- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.595
Molar Refractivity: 189.4±0.3 cm3
#H bond acceptors:
#H bond donors:
#Freely Rotating Bonds:
#Rule of 5 Violations:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area:
Polarizability: 75.1±0.5 10-24cm3
Surface Tension: 44.7±3.0 dyne/cm
Molar Volume: 557.1±3.0 cm3

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