ChemSpider 2D Image | 2,3-Dimethoxy-5-methyl-6-[(11S)-3,7,11-trimethylhexadecyl]-1,4-benzenediol | C28H50O4

2,3-Dimethoxy-5-methyl-6-[(11S)-3,7,11-trimethylhexadecyl]-1,4-benzenediol

  • Molecular FormulaC28H50O4
  • Average mass450.694 Da
  • Monoisotopic mass450.370911 Da
  • ChemSpider ID61715262

  • defined stereocentres - 1 of 3 defined stereocentres

More details:

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

1,4-Benzenediol, 2,3-dimethoxy-5-methyl-6-[(11S)-3,7,11-trimethylhexadecyl]- [ACD/Index Name]
1,4-Benzenediol, 2,3-dimethoxy-5-methyl-6-[(3R,7S,11S)-3,7,11-trimethylhexadecyl]- [ACD/Index Name]
2,3-Dimethoxy-5-methyl-6-[(11S)-3,7,11-trimethylhexadecyl]-1,4-benzenediol [ACD/IUPAC Name]
2,3-Diméthoxy-5-méthyl-6-[(11S)-3,7,11-triméthylhexadécyl]-1,4-benzènediol [French] [ACD/IUPAC Name]
2,3-Dimethoxy-5-methyl-6-[(11S)-3,7,11-trimethylhexadecyl]-1,4-benzoldiol [German] [ACD/IUPAC Name]
2,3-Dimethoxy-5-methyl-6-[(3R,7S,11S)-3,7,11-trimethylhexadecyl]-1,4-benzenediol [ACD/IUPAC Name]
2,3-Diméthoxy-5-méthyl-6-[(3R,7S,11S)-3,7,11-triméthylhexadécyl]-1,4-benzènediol [French] [ACD/IUPAC Name]
2,3-Dimethoxy-5-methyl-6-[(3R,7S,11S)-3,7,11-trimethylhexadecyl]-1,4-benzoldiol [German] [ACD/IUPAC Name]
U10
Ubiquinone-10

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

Density: 1.0±0.1 g/cm3
Boiling Point: 559.5±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.3±3.0 kJ/mol
Flash Point: 292.2±28.7 °C
Index of Refraction: 1.498
Molar Refractivity: 136.4±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 17
#Rule of 5 Violations: 1
ACD/LogP: 10.13
ACD/LogD (pH 5.5): 8.96
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 1779168.00
ACD/LogD (pH 7.4): 8.96
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 1777576.63
Polar Surface Area: 59 Å2
Polarizability: 54.1±0.5 10-24cm3
Surface Tension: 35.3±3.0 dyne/cm
Molar Volume: 465.1±3.0 cm3

Click to predict properties on the Chemicalize site


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