ChemSpider 2D Image | 3,3-Difluoro-4-methyl-1-{[(2-methyl-2-propanyl)oxy]carbonyl}-4-piperidinecarboxylic acid | C12H19F2NO4

3,3-Difluoro-4-methyl-1-{[(2-methyl-2-propanyl)oxy]carbonyl}-4-piperidinecarboxylic acid

  • Molecular FormulaC12H19F2NO4
  • Average mass279.280 Da
  • Monoisotopic mass279.128204 Da
  • ChemSpider ID45506763

More details:

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

1,4-Piperidinedicarboxylic acid, 3,3-difluoro-4-methyl-, 1-(1,1-dimethylethyl) ester [ACD/Index Name]
3,3-Difluor-4-methyl-1-{[(2-methyl-2-propanyl)oxy]carbonyl}-4-piperidincarbonsäure [German] [ACD/IUPAC Name]
3,3-Difluoro-4-methyl-1-{[(2-methyl-2-propanyl)oxy]carbonyl}-4-piperidinecarboxylic acid [ACD/IUPAC Name]
Acide 3,3-difluoro-4-méthyl-1-{[(2-méthyl-2-propanyl)oxy]carbonyl}-4-pipéridinecarboxylique [French] [ACD/IUPAC Name]
1-[(tert-butoxy)carbonyl]-3,3-difluoro-4-methylpiperidine-4-carboxylic acid
1334414-61-7 [RN]
1-tert-butoxycarbonyl-3,3-difluoro-4-methyl-piperidine-4-carboxylic acid
MFCD19686601

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

Density: 1.2±0.1 g/cm3
Boiling Point: 357.7±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 66.3±6.0 kJ/mol
Flash Point: 170.1±27.9 °C
Index of Refraction: 1.476
Molar Refractivity: 63.2±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.75
ACD/LogD (pH 5.5): 0.07
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.61
ACD/LogD (pH 7.4): -1.33
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 67 Å2
Polarizability: 25.1±0.5 10-24cm3
Surface Tension: 39.7±5.0 dyne/cm
Molar Volume: 223.9±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement