ChemSpider 2D Image | 2-Methyl-2-propanyl [(1R,2R)-1,3-dihydroxy-1-phenyl-2-propanyl]carbamate | C14H21NO4

2-Methyl-2-propanyl [(1R,2R)-1,3-dihydroxy-1-phenyl-2-propanyl]carbamate

  • Molecular FormulaC14H21NO4
  • Average mass267.321 Da
  • Monoisotopic mass267.147064 Da
  • ChemSpider ID22803507

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

[(1R,2R)-1,3-Dihydroxy-1-phényl-2-propanyl]carbamate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
2-Methyl-2-propanyl [(1R,2R)-1,3-dihydroxy-1-phenyl-2-propanyl]carbamate [ACD/IUPAC Name]
2-Methyl-2-propanyl-[(1R,2R)-1,3-dihydroxy-1-phenyl-2-propanyl]carbamat [German] [ACD/IUPAC Name]
Carbamic acid, N-[(1R,2R)-2-hydroxy-1-(hydroxymethyl)-2-phenylethyl]-, 1,1-dimethylethyl ester [ACD/Index Name]
1009093-14-4 [RN]
1214754-35-4 [RN]
Boc-(1R,2R)-(-)-2-amino-1-phenyl-1,3-propanediol
BOC-D-threo-3-phenylserinol
MFCD04974332 [MDL number]
N-[(1R,2R)-2-Hydroxy-1-(hydroxymethyl)-2-phenylethyl]carbamic Acid tert-Butyl Ester
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.2±0.1 g/cm3
Boiling Point: 453.8±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.2±3.0 kJ/mol
Flash Point: 228.3±28.7 °C
Index of Refraction: 1.539
Molar Refractivity: 72.0±0.3 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.28
ACD/LogD (pH 5.5): 1.91
ACD/BCF (pH 5.5): 16.65
ACD/KOC (pH 5.5): 260.58
ACD/LogD (pH 7.4): 1.91
ACD/BCF (pH 7.4): 16.65
ACD/KOC (pH 7.4): 260.55
Polar Surface Area: 79 Å2
Polarizability: 28.5±0.5 10-24cm3
Surface Tension: 46.5±3.0 dyne/cm
Molar Volume: 229.8±3.0 cm3

Click to predict properties on the Chemicalize site


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