ChemSpider 2D Image | tert-Butyl 3-(aminomethyl)-3-[(tert-butoxycarbonyl)amino]-1-pyrrolidinecarboxylate | C15H29N3O4

tert-Butyl 3-(aminomethyl)-3-[(tert-butoxycarbonyl)amino]-1-pyrrolidinecarboxylate

  • Molecular FormulaC15H29N3O4
  • Average mass315.409 Da
  • Monoisotopic mass315.215820 Da
  • ChemSpider ID29313808

More details:

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

1-Pyrrolidinecarboxylic acid, 3-(aminomethyl)-3-[[(1,1-dimethylethoxy)carbonyl]amino]-, 1,1-dimethylethyl ester [ACD/Index Name]
2-Methyl-2-propanyl 3-(aminomethyl)-3-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)-1-pyrrolidinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-3-(aminomethyl)-3-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)-1-pyrrolidincarboxylat [German] [ACD/IUPAC Name]
3-(Aminométhyl)-3-({[(2-méthyl-2-propanyl)oxy]carbonyl}amino)-1-pyrrolidinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
MFCD22199286 [MDL number]
tert-Butyl 3-(aminomethyl)-3-[(tert-butoxycarbonyl)amino]-1-pyrrolidinecarboxylate
1364663-28-4 [RN]
tert-butyl 3-(aminomethyl)-3-(tert-butoxycarbonylamino)pyrrolidine-1-carboxylate
tert-Butyl 3-(aminomethyl)-3-(tert-butoxy-carbonylamino)pyrrolidine-1-carboxylate
tert-butyl 3-(aminomethyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]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: 423.3±38.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.8±3.0 kJ/mol
Flash Point: 209.8±26.8 °C
Index of Refraction: 1.509
Molar Refractivity: 84.3±0.4 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.59
ACD/LogD (pH 5.5): -1.30
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.63
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 94 Å2
Polarizability: 33.4±0.5 10-24cm3
Surface Tension: 43.5±5.0 dyne/cm
Molar Volume: 282.5±5.0 cm3

Click to predict properties on the Chemicalize site


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