ChemSpider 2D Image | Dimethyl (2R,4R)-2-benzyl-4-{[(3R,5R)-5-(methoxycarbonyl)-3,5-dimethyl-2-oxotetrahydro-3-furanyl]methyl}-2,4-dimethylpentanedioate (non-preferred name) | C25H34O8

Dimethyl (2R,4R)-2-benzyl-4-{[(3R,5R)-5-(methoxycarbonyl)-3,5-dimethyl-2-oxotetrahydro-3-furanyl]methyl}-2,4-dimethylpentanedioate (non-preferred name)

  • Molecular FormulaC25H34O8
  • Average mass462.533 Da
  • Monoisotopic mass462.225372 Da
  • ChemSpider ID62450695

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

(2R,4R)-2-Benzyl-4-{[(3R,5R)-5-(méthoxycarbonyl)-3,5-diméthyl-2-oxotétrahydro-3-furanyl]méthyl}-2,4-diméthylpentanedioate de diméthyle (non-preferred name) [French] [ACD/IUPAC Name]
Dimethyl (2R,4R)-2-benzyl-4-{[(3R,5R)-5-(methoxycarbonyl)-3,5-dimethyl-2-oxotetrahydro-3-furanyl]methyl}-2,4-dimethylpentanedioate (non-preferred name) [ACD/IUPAC Name]
Dimethyl-(2R,4R)-2-benzyl-4-{[(3R,5R)-5-(methoxycarbonyl)-3,5-dimethyl-2-oxotetrahydro-3-furanyl]methyl}-2,4-dimethylpentandioat (non-preferred name) [German] [ACD/IUPAC Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 552.3±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 83.3±3.0 kJ/mol
Flash Point: 234.3±30.2 °C
Index of Refraction: 1.502
Molar Refractivity: 119.4±0.3 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 0
ACD/LogP: 3.01
ACD/LogD (pH 5.5): 3.67
ACD/BCF (pH 5.5): 363.81
ACD/KOC (pH 5.5): 2369.62
ACD/LogD (pH 7.4): 3.67
ACD/BCF (pH 7.4): 363.81
ACD/KOC (pH 7.4): 2369.62
Polar Surface Area: 105 Å2
Polarizability: 47.3±0.5 10-24cm3
Surface Tension: 40.8±3.0 dyne/cm
Molar Volume: 404.6±3.0 cm3

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