ChemSpider 2D Image | 2-Methyl-2-propanyl 2-(5-amino-1H-pyrazol-3-yl)-1-pyrrolidinecarboxylate | C12H20N4O2

2-Methyl-2-propanyl 2-(5-amino-1H-pyrazol-3-yl)-1-pyrrolidinecarboxylate

  • Molecular FormulaC12H20N4O2
  • Average mass252.313 Da
  • Monoisotopic mass252.158630 Da
  • ChemSpider ID26951728

More details:






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

1-Pyrrolidinecarboxylic acid, 2-(5-amino-1H-pyrazol-3-yl)-, 1,1-dimethylethyl ester [ACD/Index Name]
2-(5-Amino-1H-pyrazol-3-yl)-1-pyrrolidinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
2-Methyl-2-propanyl 2-(5-amino-1H-pyrazol-3-yl)-1-pyrrolidinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-2-(5-amino-1H-pyrazol-3-yl)-1-pyrrolidincarboxylat [German] [ACD/IUPAC Name]
1396967-66-0 [RN]
1997355-22-2 [RN]
2-(5-AMINO-1H-PYRAZOL-3-YL)-PYRROLIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
MFCD06656719 [MDL number]
MFCD27991439
MFCD27991479
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 453.8±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 71.3±3.0 kJ/mol
Flash Point: 228.2±28.7 °C
Index of Refraction: 1.578
Molar Refractivity: 68.0±0.3 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.55
ACD/LogD (pH 5.5): 0.81
ACD/BCF (pH 5.5): 2.34
ACD/KOC (pH 5.5): 60.56
ACD/LogD (pH 7.4): 0.89
ACD/BCF (pH 7.4): 2.81
ACD/KOC (pH 7.4): 72.91
Polar Surface Area: 84 Å2
Polarizability: 27.0±0.5 10-24cm3
Surface Tension: 58.0±3.0 dyne/cm
Molar Volume: 205.0±3.0 cm3

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