ChemSpider 2D Image | (S)-tert-Butyl 2,2-dimethyl-4-(((R)-tetrahydro-2H-pyran-3-yl)methyl)oxazolidine-3-carboxylate | C16H29NO4

(S)-tert-Butyl 2,2-dimethyl-4-(((R)-tetrahydro-2H-pyran-3-yl)methyl)oxazolidine-3-carboxylate

  • Molecular FormulaC16H29NO4
  • Average mass299.406 Da
  • Monoisotopic mass299.209656 Da
  • ChemSpider ID28600442

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(4S)-2,2-Diméthyl-4-[(3R)-tétrahydro-2H-pyran-3-ylméthyl]-1,3-oxazolidine-3-carboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
(S)-tert-Butyl 2,2-dimethyl-4-(((R)-tetrahydro-2H-pyran-3-yl)methyl)oxazolidine-3-carboxylate
2-Methyl-2-propanyl (4S)-2,2-dimethyl-4-[(3R)-tetrahydro-2H-pyran-3-ylmethyl]-1,3-oxazolidine-3-carboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-(4S)-2,2-dimethyl-4-[(3R)-tetrahydro-2H-pyran-3-ylmethyl]-1,3-oxazolidin-3-carboxylat [German] [ACD/IUPAC Name]
3-Oxazolidinecarboxylic acid, 2,2-dimethyl-4-[[(3R)-tetrahydro-2H-pyran-3-yl]methyl]-, 1,1-dimethylethyl ester, (4S)- [ACD/Index Name]
942144-34-5 [RN]
tert-Butyl (4S)-2,2-dimethyl-4-{[(3R)-oxan-3-yl]methyl}-1,3-oxazolidine-3-carboxylate
tert-butyl (S)-2,2-dimethyl-4-(((R)-tetrahydro-2H-pyran-3-yl)methyl)oxazolidine-3-carboxylate

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

Density: 1.0±0.1 g/cm3
Boiling Point: 380.6±27.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 62.9±3.0 kJ/mol
Flash Point: 184.0±23.7 °C
Index of Refraction: 1.472
Molar Refractivity: 80.5±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.94
ACD/LogD (pH 5.5): 2.30
ACD/BCF (pH 5.5): 32.87
ACD/KOC (pH 5.5): 423.99
ACD/LogD (pH 7.4): 2.30
ACD/BCF (pH 7.4): 32.87
ACD/KOC (pH 7.4): 423.99
Polar Surface Area: 48 Å2
Polarizability: 31.9±0.5 10-24cm3
Surface Tension: 33.7±3.0 dyne/cm
Molar Volume: 287.5±3.0 cm3

Click to predict properties on the Chemicalize site


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