ChemSpider 2D Image | para-Bromofentanyl | C22H27BrN2O

para-Bromofentanyl

  • Molecular FormulaC22H27BrN2O
  • Average mass415.367 Da
  • Monoisotopic mass414.130676 Da
  • ChemSpider ID76714532

More details:

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

117994-23-7 [RN]
N-(4-Bromophenyl)-N-[1-(2-phenylethyl)-4-piperidinyl]propanamide [ACD/IUPAC Name]
N-(4-Bromophényl)-N-[1-(2-phényléthyl)-4-pipéridinyl]propanamide [French] [ACD/IUPAC Name]
N-(4-Bromphenyl)-N-[1-(2-phenylethyl)-4-piperidinyl]propanamid [German] [ACD/IUPAC Name]
para-Bromofentanyl
Propanamide, N-(4-bromophenyl)-N-[1-(2-phenylethyl)-4-piperidinyl]- [ACD/Index Name]
CID 14129713
N-(4-bromophenyl)-N-[1-(2-phenylethyl)-4-piperidinyl]-propanamide

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

Density: 1.3±0.1 g/cm3
Boiling Point: 513.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.5±3.0 kJ/mol
Flash Point: 264.6±30.1 °C
Index of Refraction: 1.600
Molar Refractivity: 111.4±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.90
ACD/LogD (pH 5.5): 2.16
ACD/BCF (pH 5.5): 5.87
ACD/KOC (pH 5.5): 21.15
ACD/LogD (pH 7.4): 3.81
ACD/BCF (pH 7.4): 259.67
ACD/KOC (pH 7.4): 935.74
Polar Surface Area: 24 Å2
Polarizability: 44.1±0.5 10-24cm3
Surface Tension: 47.7±3.0 dyne/cm
Molar Volume: 325.6±3.0 cm3

Click to predict properties on the Chemicalize site


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