ChemSpider 2D Image | tert-Butyl 1-methyl-6,7-dihydro-1H-pyrazolo[4,3-c]pyridine-5(4H)-carboxylate | C12H19N3O2

tert-Butyl 1-methyl-6,7-dihydro-1H-pyrazolo[4,3-c]pyridine-5(4H)-carboxylate

  • Molecular FormulaC12H19N3O2
  • Average mass237.298 Da
  • Monoisotopic mass237.147720 Da
  • ChemSpider ID29339824

More details:

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

100501-56-2 [RN]
1-Méthyl-1,4,6,7-tétrahydro-5H-pyrazolo[4,3-c]pyridine-5-carboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
2-Methyl-2-propanyl 1-methyl-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridine-5-carboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-1-methyl-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridin-5-carboxylat [German] [ACD/IUPAC Name]
5H-Pyrazolo[4,3-c]pyridine-5-carboxylic acid, 1,4,6,7-tetrahydro-1-methyl-, 1,1-dimethylethyl ester [ACD/Index Name]
tert-Butyl 1-methyl-6,7-dihydro-1H-pyrazolo[4,3-c]pyridine-5(4H)-carboxylate
1-METHYL-1,4,6,7-TETRAHYDRO-PYRAZOLO-[4,3-C]PYRIDINE-5-CARBOXYLIC ACID-TERT-BUTYL ESTER
MFCD11045809 [MDL number]
tert-Butyl 1-methyl-1,4,6,7-tetrahydro-5H-pyrazolo[4,3-c]pyridine-5-carboxylate

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

Density: 1.2±0.1 g/cm3
Boiling Point: 360.1±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 60.6±3.0 kJ/mol
Flash Point: 171.6±27.9 °C
Index of Refraction: 1.569
Molar Refractivity: 65.7±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.89
ACD/LogD (pH 5.5): 2.04
ACD/BCF (pH 5.5): 20.83
ACD/KOC (pH 5.5): 305.75
ACD/LogD (pH 7.4): 2.04
ACD/BCF (pH 7.4): 20.84
ACD/KOC (pH 7.4): 305.98
Polar Surface Area: 47 Å2
Polarizability: 26.1±0.5 10-24cm3
Surface Tension: 40.3±7.0 dyne/cm
Molar Volume: 200.8±7.0 cm3

Click to predict properties on the Chemicalize site


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