ChemSpider 2D Image | VES | C33H54O5

VES

  • Molecular FormulaC33H54O5
  • Average mass530.779 Da
  • Monoisotopic mass530.397095 Da
  • ChemSpider ID19171

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

(+)-2,5,7,8-Tetramethyl-2-(4,8,12-trimethyltridecyl)-6-chromanyl Hydrogen Succinate
(+)-a-Tocopheryl Succinate
(+)-α-Tocopheryl succinate
224-403-8 [EINECS]
4345-03-3 [RN]
4-Oxo-4-(((R)-2,5,7,8-tetramethyl-2-((4R,8R)-4,8,12-trimethyltridecyl)chroman-6-yl)oxy)butanoic acid
4-Oxo-4-({(2R)-2,5,7,8-tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydro-2H-chromen-6-yl}oxy)butanoic acid [ACD/IUPAC Name]
4-Oxo-4-({(2R)-2,5,7,8-tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydro-2H-chromen-6-yl}oxy)butansäure [German] [ACD/IUPAC Name]
Acide 4-oxo-4-({(2R)-2,5,7,8-tétraméthyl-2-[(4R,8R)-4,8,12-triméthyltridécyl]-3,4-dihydro-2H-chromén-6-yl}oxy)butanoïque [French] [ACD/IUPAC Name]
a-Tocopherol Acid Succinate
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

4038233 [DBID]
03.03.4345 [DBID]
47782_SUPELCO [DBID]
95255_FLUKA [DBID]
AIDS017868 [DBID]
AIDS-017868 [DBID]
AIDS072179 [DBID]
AIDS-072179 [DBID]
CCRIS 4734 [DBID]
NSC 173849 [DBID]
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.0±0.1 g/cm3
    Boiling Point: 625.8±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.9 mmHg at 25°C
    Enthalpy of Vaporization: 97.4±3.0 kJ/mol
    Flash Point: 187.0±25.0 °C
    Index of Refraction: 1.498
    Molar Refractivity: 155.4±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 1
    #Freely Rotating Bonds: 17
    #Rule of 5 Violations: 2
    ACD/LogP: 11.88
    ACD/LogD (pH 5.5): 9.04
    ACD/BCF (pH 5.5): 1000000.00
    ACD/KOC (pH 5.5): 572766.31
    ACD/LogD (pH 7.4): 7.25
    ACD/BCF (pH 7.4): 36683.50
    ACD/KOC (pH 7.4): 9224.84
    Polar Surface Area: 73 Å2
    Polarizability: 61.6±0.5 10-24cm3
    Surface Tension: 37.5±3.0 dyne/cm
    Molar Volume: 529.6±3.0 cm3

    Click to predict properties on the Chemicalize site


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