ChemSpider 2D Image | tert-Butyl (3R)-3-[(pyridin-4-ylmethyl)amino]pyrrolidine-1-carboxylate | C15H23N3O2

tert-Butyl (3R)-3-[(pyridin-4-ylmethyl)amino]pyrrolidine-1-carboxylate

  • Molecular FormulaC15H23N3O2
  • Average mass277.362 Da
  • Monoisotopic mass277.179016 Da
  • ChemSpider ID21373618

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3R)-3-[(4-Pyridinylméthyl)amino]-1-pyrrolidinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
1-Pyrrolidinecarboxylic acid, 3-[(4-pyridinylmethyl)amino]-, 1,1-dimethylethyl ester, (3R)- [ACD/Index Name]
2-Methyl-2-propanyl (3R)-3-[(4-pyridinylmethyl)amino]-1-pyrrolidinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-(3R)-3-[(4-pyridinylmethyl)amino]-1-pyrrolidincarboxylat [German] [ACD/IUPAC Name]
tert-Butyl (3R)-3-[(pyridin-4-ylmethyl)amino]pyrrolidine-1-carboxylate
(R)-1-Boc-3-N-(Pyridin-4-ylmethyl)-amino-
(R)-1-Boc-3-N-(Pyridin-4-ylmethyl)-amino-pyrrolidine
(R)-3-[(Pyridin-4-ylmethyl)-amino]-pyrrolidine-1-carboxylic acid tert-butyl ester
(R)-tert-butyl 3-((pyridin-4-ylmethyl)amino)pyrrolidine-1-carboxylate
(R)-tert-butyl-3-((pyridin-4-ylmethyl)amino)pyrrolidine-1-carboxylate
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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: 403.7±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 65.5±3.0 kJ/mol
Flash Point: 198.0±27.3 °C
Index of Refraction: 1.547
Molar Refractivity: 78.2±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.02
ACD/LogD (pH 5.5): -0.34
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.66
ACD/LogD (pH 7.4): 1.36
ACD/BCF (pH 7.4): 5.02
ACD/KOC (pH 7.4): 82.92
Polar Surface Area: 54 Å2
Polarizability: 31.0±0.5 10-24cm3
Surface Tension: 46.7±5.0 dyne/cm
Molar Volume: 246.6±5.0 cm3

Click to predict properties on the Chemicalize site


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