ChemSpider 2D Image | 2-Methyl-2-propanyl (4R,5R)-4-[(1R)-2-amino-3,3-diethoxy-1-hydroxypropyl]-2,2,5-trimethyl-1,3-oxazolidine-3-carboxylate | C18H36N2O6

2-Methyl-2-propanyl (4R,5R)-4-[(1R)-2-amino-3,3-diethoxy-1-hydroxypropyl]-2,2,5-trimethyl-1,3-oxazolidine-3-carboxylate

  • Molecular FormulaC18H36N2O6
  • Average mass376.488 Da
  • Monoisotopic mass376.257324 Da
  • ChemSpider ID107450512

  • defined stereocentres - 3 of 4 defined stereocentres

More details:

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

(4R,5R)-4-[(1R)-2-Amino-3,3-diéthoxy-1-hydroxypropyl]-2,2,5-triméthyl-1,3-oxazolidine-3-carboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
2-Methyl-2-propanyl (4R,5R)-4-[(1R)-2-amino-3,3-diethoxy-1-hydroxypropyl]-2,2,5-trimethyl-1,3-oxazolidine-3-carboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-(4R,5R)-4-[(1R)-2-amino-3,3-diethoxy-1-hydroxypropyl]-2,2,5-trimethyl-1,3-oxazolidin-3-carboxylat [German] [ACD/IUPAC Name]
3-Oxazolidinecarboxylic acid, 4-[(1R)-2-amino-3,3-diethoxy-1-hydroxypropyl]-2,2,5-trimethyl-, 1,1-dimethylethyl ester, (4R,5R)- [ACD/Index Name]
1421856-51-0 [RN]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 477.7±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 85.5±6.0 kJ/mol
Flash Point: 242.7±28.7 °C
Index of Refraction: 1.477
Molar Refractivity: 98.7±0.3 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 3.81
ACD/LogD (pH 5.5): 1.99
ACD/BCF (pH 5.5): 13.68
ACD/KOC (pH 5.5): 151.73
ACD/LogD (pH 7.4): 2.59
ACD/BCF (pH 7.4): 53.86
ACD/KOC (pH 7.4): 597.19
Polar Surface Area: 103 Å2
Polarizability: 39.1±0.5 10-24cm3
Surface Tension: 37.4±3.0 dyne/cm
Molar Volume: 349.2±3.0 cm3

Click to predict properties on the Chemicalize site


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