ChemSpider 2D Image | 2-Methyl-2-propanyl 3-amino-2-methyl-2,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridine-5-carboxylate | C12H20N4O2

2-Methyl-2-propanyl 3-amino-2-methyl-2,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridine-5-carboxylate

  • Molecular FormulaC12H20N4O2
  • Average mass252.313 Da
  • Monoisotopic mass252.158630 Da
  • ChemSpider ID24744871

More details:






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

2-Methyl-2-propanyl 3-amino-2-methyl-2,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridine-5-carboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-3-amino-2-methyl-2,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-carboxylat [German] [ACD/IUPAC Name]
3-Amino-2-méthyl-2,4,6,7-tétrahydro-5H-pyrazolo[4,3-c]pyridine-5-carboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
5H-Pyrazolo[4,3-c]pyridine-5-carboxylic acid, 3-amino-2,4,6,7-tetrahydro-2-methyl-, 1,1-dimethylethyl ester [ACD/Index Name]
1245558-98-8 [RN]
MFCD29050604
NS-03777
tert-butyl 3-amino-2-methyl-2H,4H,5H,6H,7H-pyrazolo[4,3-c]pyridine-5-carboxylate

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 418.6±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.2±3.0 kJ/mol
Flash Point: 207.0±28.7 °C
Index of Refraction: 1.601
Molar Refractivity: 67.7±0.5 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.28
ACD/LogD (pH 5.5): 0.90
ACD/BCF (pH 5.5): 2.83
ACD/KOC (pH 5.5): 72.87
ACD/LogD (pH 7.4): 0.91
ACD/BCF (pH 7.4): 2.89
ACD/KOC (pH 7.4): 74.37
Polar Surface Area: 73 Å2
Polarizability: 26.8±0.5 10-24cm3
Surface Tension: 45.4±7.0 dyne/cm
Molar Volume: 197.6±7.0 cm3

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