ChemSpider 2D Image | 1-(1-Isobutyryl-4-piperidinyl)-3-[4-(trifluoromethyl)phenyl]urea | C17H22F3N3O2

1-(1-Isobutyryl-4-piperidinyl)-3-[4-(trifluoromethyl)phenyl]urea

  • Molecular FormulaC17H22F3N3O2
  • Average mass357.371 Da
  • Monoisotopic mass357.166412 Da
  • ChemSpider ID35034917

More details:

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

1-(1-Isobutyryl-4-piperidinyl)-3-[4-(trifluormethyl)phenyl]harnstoff [German] [ACD/IUPAC Name]
1-(1-Isobutyryl-4-piperidinyl)-3-[4-(trifluoromethyl)phenyl]urea [ACD/IUPAC Name]
1-(1-Isobutyryl-4-pipéridinyl)-3-[4-(trifluorométhyl)phényl]urée [French] [ACD/IUPAC Name]
1-[1-(2-Methylpropanoyl)piperidin-4-Yl]-3-[4-(Trifluoromethyl)phenyl]urea
Urea, N-[1-(2-methyl-1-oxopropyl)-4-piperidinyl]-N'-[4-(trifluoromethyl)phenyl]- [ACD/Index Name]
1020266-51-6 [RN]
2RU
3-[1-(2-methylpropanoyl)piperidin-4-yl]-1-[4-(trifluoromethyl)phenyl]urea

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

Density: 1.3±0.1 g/cm3
Boiling Point: 455.7±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 71.6±3.0 kJ/mol
Flash Point: 229.4±28.7 °C
Index of Refraction: 1.529
Molar Refractivity: 87.4±0.4 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.00
ACD/LogD (pH 5.5): 2.79
ACD/BCF (pH 5.5): 77.18
ACD/KOC (pH 5.5): 781.03
ACD/LogD (pH 7.4): 2.79
ACD/BCF (pH 7.4): 77.17
ACD/KOC (pH 7.4): 781.00
Polar Surface Area: 61 Å2
Polarizability: 34.6±0.5 10-24cm3
Surface Tension: 43.0±5.0 dyne/cm
Molar Volume: 283.5±5.0 cm3

Click to predict properties on the Chemicalize site


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