ChemSpider 2D Image | carboxyfentanyl | C23H28N2O3

carboxyfentanyl

  • Molecular FormulaC23H28N2O3
  • Average mass380.480 Da
  • Monoisotopic mass380.209991 Da
  • ChemSpider ID23276103

More details:

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

4-oxo-4-((1-phenethylpiperidin-4-yl)(phenyl)amino)butanoic acid
4-Oxo-4-{phenyl[1-(2-phenylethyl)-4-piperidinyl]amino}butanoic acid [ACD/IUPAC Name]
4-Oxo-4-{phenyl[1-(2-phenylethyl)-4-piperidinyl]amino}butansäure [German] [ACD/IUPAC Name]
4-oxo-4-{phenyl[1-(2-phenylethyl)piperidin-4-yl]amino}butanoic acid
52994-23-7 [RN]
Acide 4-oxo-4-{phényl[1-(2-phényléthyl)-4-pipéridinyl]amino}butanoïque [French] [ACD/IUPAC Name]
Butanoic acid, 4-oxo-4-[phenyl[1-(2-phenylethyl)-4-piperidinyl]amino]- [ACD/Index Name]
Butyryl fentanyl carboxy metabolite
carboxyfentanyl
3-{PHENYL[1-(2-PHENYLETHYL)PIPERIDIN-4-YL]CARBAMOYL}PROPANOIC ACID
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.2±0.1 g/cm3
Boiling Point: 555.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 88.1±3.0 kJ/mol
Flash Point: 289.8±30.1 °C
Index of Refraction: 1.601
Molar Refractivity: 109.9±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 3.16
ACD/LogD (pH 5.5): 0.43
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.92
ACD/LogD (pH 7.4): 0.43
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.89
Polar Surface Area: 61 Å2
Polarizability: 43.6±0.5 10-24cm3
Surface Tension: 53.5±3.0 dyne/cm
Molar Volume: 320.5±3.0 cm3

Click to predict properties on the Chemicalize site


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