ChemSpider 2D Image | 2-Methyl-2-propanyl (1-alanyl-4-piperidinyl)carbamate | C13H25N3O3

2-Methyl-2-propanyl (1-alanyl-4-piperidinyl)carbamate

  • Molecular FormulaC13H25N3O3
  • Average mass271.356 Da
  • Monoisotopic mass271.189606 Da
  • ChemSpider ID25995615

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(1-Alanyl-4-pipéridinyl)carbamate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
2-Methyl-2-propanyl (1-alanyl-4-piperidinyl)carbamate [ACD/IUPAC Name]
2-Methyl-2-propanyl-(1-alanyl-4-piperidinyl)carbamat [German] [ACD/IUPAC Name]
Carbamic acid, N-[1-[(2S)-2-amino-1-oxopropyl]-4-piperidinyl]-, 1,1-dimethylethyl ester [ACD/Index Name]
(S)-tert-Butyl (1-(2-aminopropanoyl)piperidin-4-yl)carbamate
[1-((S)-2-aminopropionyl)piperidin-4-yl]carbamic acid tert-butyl ester
[1-((S)-2-aminopropionyl)piperidin-4-yl]-carbamic acid tert-butyl ester
[1-((S)-2-Amino-propionyl)-piperidin-4-yl]-carbamic acid tert-butyl ester
1305712-82-6 [RN]
MFCD18089594 [MDL number]
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.1±0.1 g/cm3
Boiling Point: 432.3±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.8±3.0 kJ/mol
Flash Point: 215.3±28.7 °C
Index of Refraction: 1.512
Molar Refractivity: 73.3±0.4 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.72
ACD/LogD (pH 5.5): -2.19
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.55
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.94
Polar Surface Area: 85 Å2
Polarizability: 29.1±0.5 10-24cm3
Surface Tension: 43.8±5.0 dyne/cm
Molar Volume: 244.3±5.0 cm3

Click to predict properties on the Chemicalize site


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