ChemSpider 2D Image | 1-[6-(Trifluoromethyl)-4-pyrimidinyl]-4-piperidinecarboxylic acid | C11H12F3N3O2

1-[6-(Trifluoromethyl)-4-pyrimidinyl]-4-piperidinecarboxylic acid

  • Molecular FormulaC11H12F3N3O2
  • Average mass275.227 Da
  • Monoisotopic mass275.088165 Da
  • ChemSpider ID29304359

More details:






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

1-[6-(Trifluormethyl)-4-pyrimidinyl]-4-piperidincarbonsäure [German] [ACD/IUPAC Name]
1-[6-(Trifluoromethyl)-4-pyrimidinyl]-4-piperidinecarboxylic acid [ACD/IUPAC Name]
1-[6-(Trifluoromethyl)pyrimidin-4-yl]piperidine-4-carboxylic acid
1448854-86-1 [RN]
4-Piperidinecarboxylic acid, 1-[6-(trifluoromethyl)-4-pyrimidinyl]- [ACD/Index Name]
Acide 1-[6-(trifluorométhyl)-4-pyrimidinyl]-4-pipéridinecarboxylique [French] [ACD/IUPAC Name]
[1448854-86-1]
1-(6-(Trifluoromethyl)pyrimidin-4-yl)piperidine-4-carboxylic acid
1-(6-Trifluoromethyl-pyrimidin-4-yl)-piperidine-4-carboxylic acid
AKOS024450239
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point: 429.0±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 72.1±3.0 kJ/mol
Flash Point: 213.2±28.7 °C
Index of Refraction: 1.514
Molar Refractivity: 58.3±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.72
ACD/LogD (pH 5.5): 0.62
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 14.19
ACD/LogD (pH 7.4): -1.17
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 66 Å2
Polarizability: 23.1±0.5 10-24cm3
Surface Tension: 49.4±3.0 dyne/cm
Molar Volume: 193.9±3.0 cm3

Click to predict properties on the Chemicalize site






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