ChemSpider 2D Image | 1,1-Dimethylethyl 3-amino-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridine-5-carboxylate | C11H18N4O2

1,1-Dimethylethyl 3-amino-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridine-5-carboxylate

  • Molecular FormulaC11H18N4O2
  • Average mass238.286 Da
  • Monoisotopic mass238.142975 Da
  • ChemSpider ID26876325

More details:






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

1,1-Dimethylethyl 3-amino-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridine-5-carboxylate
2-Methyl-2-propanyl 3-amino-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridine-5-carboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-3-amino-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-carboxylat [German] [ACD/IUPAC Name]
398491-64-0 [RN]
3-Amino-1,4,6,7-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-1,4,6,7-tetrahydro-, 1,1-dimethylethyl ester [ACD/Index Name]
[398491-64-0]
1709843-95-7 [RN]
3-Amino-5-Boc-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine
https://mcule.com/MCULE-5992645983
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 451.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 71.1±3.0 kJ/mol
Flash Point: 227.1±28.7 °C
Index of Refraction: 1.590
Molar Refractivity: 63.6±0.3 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.43
ACD/LogD (pH 5.5): 1.37
ACD/BCF (pH 5.5): 6.20
ACD/KOC (pH 5.5): 121.22
ACD/LogD (pH 7.4): 1.46
ACD/BCF (pH 7.4): 7.59
ACD/KOC (pH 7.4): 148.37
Polar Surface Area: 84 Å2
Polarizability: 25.2±0.5 10-24cm3
Surface Tension: 60.8±3.0 dyne/cm
Molar Volume: 188.3±3.0 cm3

Click to predict properties on the Chemicalize site






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