ChemSpider 2D Image | 4-(4-CARBOXY-PYRAZOL-1-YL)-PIPERIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER | C14H21N3O4

4-(4-CARBOXY-PYRAZOL-1-YL)-PIPERIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER

  • Molecular FormulaC14H21N3O4
  • Average mass295.334 Da
  • Monoisotopic mass295.153198 Da
  • ChemSpider ID29354793

More details:

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

1-(1-{[(2-Methyl-2-propanyl)oxy]carbonyl}-4-piperidinyl)-1H-pyrazol-4-carbonsäure [German] [ACD/IUPAC Name]
1-(1-{[(2-Methyl-2-propanyl)oxy]carbonyl}-4-piperidinyl)-1H-pyrazole-4-carboxylic acid [ACD/IUPAC Name]
1034976-50-5 [RN]
1-Piperidinecarboxylic acid, 4-(4-carboxy-1H-pyrazol-1-yl)-, 1-(1,1-dimethylethyl) ester [ACD/Index Name]
4-(4-CARBOXY-PYRAZOL-1-YL)-PIPERIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
Acide 1-(1-{[(2-méthyl-2-propanyl)oxy]carbonyl}-4-pipéridinyl)-1H-pyrazole-4-carboxylique [French] [ACD/IUPAC Name]
1-(1-(tert-butoxycarbonyl)piperidin-4-yl)-1H-pyrazole-4-carboxylic acid
1-[1-(TERT-BUTOXYCARBONYL)PIPERIDIN-4-YL]PYRAZOLE-4-CARBOXYLIC ACID
1-{1-[(tert-butoxy)carbonyl]piperidin-4-yl}-1H-pyrazole-4-carboxylic acid
4-(4-Carboxy-pyrazol-1-yl)-piperidine-1-carboxylic
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.3±0.1 g/cm3
Boiling Point: 470.7±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 77.3±3.0 kJ/mol
Flash Point: 238.5±25.9 °C
Index of Refraction: 1.588
Molar Refractivity: 76.9±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.59
ACD/LogD (pH 5.5): 1.11
ACD/BCF (pH 5.5): 1.94
ACD/KOC (pH 5.5): 23.05
ACD/LogD (pH 7.4): -0.43
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 85 Å2
Polarizability: 30.5±0.5 10-24cm3
Surface Tension: 48.2±7.0 dyne/cm
Molar Volume: 228.4±7.0 cm3

Click to predict properties on the Chemicalize site


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