ChemSpider 2D Image | Vitamin E-(trimethylphenyl-13C9) | C2013C9H50O2

Vitamin E-(trimethylphenyl-13C9)

  • Molecular FormulaC2013C9H50O2
  • Average mass439.640 Da
  • Monoisotopic mass439.411285 Da
  • ChemSpider ID58824829

  • defined stereocentres - 2 of 3 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

2H-1-Benzopyran-6-ol-4a,5,6,7,8,8a-13C6, 3,4-dihydro-2-methyl-5,7,8-tri(methyl-13C)-2-[(4R,8R)-4,8,12-trimethyltridecyl]- [ACD/Index Name]
2-Methyl-5,7,8-tris[(13C)methyl]-2-[(4R,8R)-4,8,12-trimethyltridecyl]-6-(4a,5,6,7,8,8a-13C6)chromanol [German] [ACD/IUPAC Name]
2-Methyl-5,7,8-tris[(13C)methyl]-2-[(4R,8R)-4,8,12-trimethyltridecyl]-6-(4a,5,6,7,8,8a-13C6)chromanol [ACD/IUPAC Name]
2-Méthyl-5,7,8-tris[(13C)méthyl]-2-[(4R,8R)-4,8,12-triméthyltridécyl]-6-(4a,5,6,7,8,8a-13C6)chromanol [French] [ACD/IUPAC Name]
Vitamin E-(trimethylphenyl-13C9)
α-Tocopherol-(trimethylphenyl-13C9)

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

Density: 0.9±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.495
Molar Refractivity: 135.1±0.3 cm3
#H bond acceptors:
#H bond donors:
#Freely Rotating Bonds:
#Rule of 5 Violations:
ACD/LogP:
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: 53.5±0.5 10-24cm3
Surface Tension: 34.7±3.0 dyne/cm
Molar Volume: 462.8±3.0 cm3

Click to predict properties on the Chemicalize site


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