ChemSpider 2D Image | 3-Ethyl 5-(2-methyl-2-propanyl) 1-isopropyl-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridine-3,5-dicarboxylate | C17H27N3O4

3-Ethyl 5-(2-methyl-2-propanyl) 1-isopropyl-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridine-3,5-dicarboxylate

  • Molecular FormulaC17H27N3O4
  • Average mass337.414 Da
  • Monoisotopic mass337.200165 Da
  • ChemSpider ID30657221

More details:

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

1-Isopropyl-1,4,6,7-tétrahydro-5H-pyrazolo[4,3-c]pyridine-3,5-dicarboxylate de 3-éthyle et de 5-(2-méthyl-2-propanyle) [French] [ACD/IUPAC Name]
3-Ethyl 5-(2-methyl-2-propanyl) 1-isopropyl-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridine-3,5-dicarboxylate [ACD/IUPAC Name]
3-Ethyl-5-(2-methyl-2-propanyl)-1-isopropyl-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-3,5-dicarboxylat [German] [ACD/IUPAC Name]
5H-Pyrazolo[4,3-c]pyridine-3,5-dicarboxylic acid, 1,4,6,7-tetrahydro-1-(1-methylethyl)-, 5-(1,1-dimethylethyl) 3-ethyl ester [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.2±0.1 g/cm3
Boiling Point: 469.3±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 73.2±3.0 kJ/mol
Flash Point: 237.6±28.7 °C
Index of Refraction: 1.553
Molar Refractivity: 90.7±0.5 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.08
ACD/LogD (pH 5.5): 3.07
ACD/BCF (pH 5.5): 126.94
ACD/KOC (pH 5.5): 1115.21
ACD/LogD (pH 7.4): 3.07
ACD/BCF (pH 7.4): 126.94
ACD/KOC (pH 7.4): 1115.21
Polar Surface Area: 74 Å2
Polarizability: 35.9±0.5 10-24cm3
Surface Tension: 39.2±7.0 dyne/cm
Molar Volume: 283.2±7.0 cm3

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