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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]
4038233
4345-03-3 [RN]
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
More...

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

47782_SUPELCO [DBID]
95255_FLUKA [DBID]
AIDS017868 [DBID]
AIDS-017868 [DBID]
AIDS072179 [DBID]
AIDS-072179 [DBID]
CCRIS 4734 [DBID]
NSC 173849 [DBID]
NSC173849 [DBID]
T3126_SIGMA [DBID]

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

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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