ChemSpider 2D Image | Benzyl 4-ethynyl-4-fluoro-1-piperidinecarboxylate | C15H16FNO2

Benzyl 4-ethynyl-4-fluoro-1-piperidinecarboxylate

  • Molecular FormulaC15H16FNO2
  • Average mass261.291 Da
  • Monoisotopic mass261.116516 Da
  • ChemSpider ID58836600

More details:

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

1-Piperidinecarboxylic acid, 4-ethynyl-4-fluoro-, phenylmethyl ester [ACD/Index Name]
4-Éthynyl-4-fluoro-1-pipéridinecarboxylate de benzyle [French] [ACD/IUPAC Name]
Benzyl 4-ethynyl-4-fluoro-1-piperidinecarboxylate [ACD/IUPAC Name]
Benzyl-4-ethinyl-4-fluor-1-piperidincarboxylat [German] [ACD/IUPAC Name]
495415-74-2 [RN]
benzyl 4-ethynyl-4-fluoropiperidine-1-carboxylate
benzyl4-ethynyl-4-fluoropiperidine-1-carboxylate
benzyl4-ethynyl-4-fluoro-piperidine-1-carboxylate
MFCD27986999

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

Density: 1.2±0.1 g/cm3
Boiling Point: 349.2±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 59.4±3.0 kJ/mol
Flash Point: 165.0±27.9 °C
Index of Refraction: 1.552
Molar Refractivity: 70.1±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.58
ACD/LogD (pH 5.5): 2.94
ACD/BCF (pH 5.5): 100.56
ACD/KOC (pH 5.5): 943.96
ACD/LogD (pH 7.4): 2.94
ACD/BCF (pH 7.4): 100.56
ACD/KOC (pH 7.4): 943.96
Polar Surface Area: 30 Å2
Polarizability: 27.8±0.5 10-24cm3
Surface Tension: 46.2±5.0 dyne/cm
Molar Volume: 219.2±5.0 cm3

Click to predict properties on the Chemicalize site


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