ChemSpider 2D Image | 1-BOC-4-[(2-FLUORO-PHENYLAMINO)-METHYL]-PIPERIDINE | C17H25FN2O2

1-BOC-4-[(2-FLUORO-PHENYLAMINO)-METHYL]-PIPERIDINE

  • Molecular FormulaC17H25FN2O2
  • Average mass308.391 Da
  • Monoisotopic mass308.190002 Da
  • ChemSpider ID28567557

More details:

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

1,1-Dimethylethyl 4-[[(2-fluorophenyl)amino]methyl]-1-piperidinecarboxylate
1-BOC-4-[(2-FLUORO-PHENYLAMINO)-METHYL]-PIPERIDINE
1-Piperidinecarboxylic acid, 4-[[(2-fluorophenyl)amino]methyl]-, 1,1-dimethylethyl ester [ACD/Index Name]
2-Methyl-2-propanyl 4-{[(2-fluorophenyl)amino]methyl}-1-piperidinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-4-{[(2-fluorphenyl)amino]methyl}-1-piperidincarboxylat [German] [ACD/IUPAC Name]
4-{[(2-Fluorophényl)amino]méthyl}-1-pipéridinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
887582-20-9 [RN]
1-boc-4-[(2-fluorophenylamino)methyl]piperidine
1-boc-4-[(2-fluorophenylamino)-methyl]piperidine
1-PIPERIDINECARBOXYLICACID, 4-[[(2-FLUOROPHENYL)AMINO]METHYL]-, 1,1-DIMETHYLETHYL ESTER
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.1±0.1 g/cm3
Boiling Point: 412.1±20.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 66.5±3.0 kJ/mol
Flash Point: 203.0±21.8 °C
Index of Refraction: 1.535
Molar Refractivity: 85.3±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.04
ACD/LogD (pH 5.5): 3.57
ACD/BCF (pH 5.5): 303.76
ACD/KOC (pH 5.5): 2078.21
ACD/LogD (pH 7.4): 3.57
ACD/BCF (pH 7.4): 305.98
ACD/KOC (pH 7.4): 2093.41
Polar Surface Area: 42 Å2
Polarizability: 33.8±0.5 10-24cm3
Surface Tension: 41.9±3.0 dyne/cm
Molar Volume: 273.8±3.0 cm3

Click to predict properties on the Chemicalize site


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