ChemSpider 2D Image | 4-[(4-Bromophenyl)(ethoxyimino)methyl]-1-{1-[(2,4-dimethyl-1-oxido-3-pyridinyl)carbonyl]-4-methyl-4-piperidinyl}piperidinium | C28H38BrN4O3

4-[(4-Bromophenyl)(ethoxyimino)methyl]-1-{1-[(2,4-dimethyl-1-oxido-3-pyridinyl)carbonyl]-4-methyl-4-piperidinyl}piperidinium

  • Molecular FormulaC28H38BrN4O3
  • Average mass558.530 Da
  • Monoisotopic mass557.212158 Da
  • ChemSpider ID21239694

  • Charge - Charge

More details:

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

4-[(4-Bromophenyl)(ethoxyimino)methyl]-1-{1-[(2,4-dimethyl-1-oxido-3-pyridinyl)carbonyl]-4-methyl-4-piperidinyl}piperidinium [ACD/IUPAC Name]
4-[(4-Bromophényl)(éthoxyimino)méthyl]-1-{1-[(2,4-diméthyl-1-oxydo-3-pyridinyl)carbonyl]-4-méthyl-4-pipéridinyl}pipéridinium [French] [ACD/IUPAC Name]
4-[(4-Bromphenyl)(ethoxyimino)methyl]-1-{1-[(2,4-dimethyl-1-oxido-3-pyridinyl)carbonyl]-4-methyl-4-piperidinyl}piperidinium [German] [ACD/IUPAC Name]
Methanone, (4-bromophenyl)[1'-[(2,4-dimethyl-1-oxido-3-pyridinyl)carbonyl]-4'-methyl[1,4'-bipiperidin]-4-yl]-, O-ethyloxime, conjugate monoacid [ACD/Index Name]

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

Density:
Boiling Point: 700.1±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 102.5±3.0 kJ/mol
Flash Point: 377.2±35.7 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 3.00
ACD/LogD (pH 5.5): 0.93
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 5.17
ACD/LogD (pH 7.4): 2.62
ACD/BCF (pH 7.4): 35.77
ACD/KOC (pH 7.4): 253.98
Polar Surface Area: 72 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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