ChemSpider 2D Image | N-[2-(3-Iodobenzyl)-3-oxo-1-cyclohexen-1-yl]-4-(4-methyl-6-oxo-1,4,5,6-tetrahydro-3-pyridazinyl)anilinium | C24H25IN3O2

N-[2-(3-Iodobenzyl)-3-oxo-1-cyclohexen-1-yl]-4-(4-methyl-6-oxo-1,4,5,6-tetrahydro-3-pyridazinyl)anilinium

  • Molecular FormulaC24H25IN3O2
  • Average mass514.378 Da
  • Monoisotopic mass514.098572 Da
  • ChemSpider ID21239261

  • Charge - Charge

More details:

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

3(2H)-Pyridazinone, 4,5-dihydro-6-[4-[[2-[(3-iodophenyl)methyl]-3-oxo-1-cyclohexen-1-yl]amino]phenyl]-5-methyl-, conjugate monoacid [ACD/Index Name]
N-[2-(3-Iodbenzyl)-3-oxo-1-cyclohexen-1-yl]-4-(4-methyl-6-oxo-1,4,5,6-tetrahydro-3-pyridazinyl)anilinium [German] [ACD/IUPAC Name]
N-[2-(3-Iodobenzyl)-3-oxo-1-cyclohexen-1-yl]-4-(4-methyl-6-oxo-1,4,5,6-tetrahydro-3-pyridazinyl)anilinium [ACD/IUPAC Name]
N-[2-(3-Iodobenzyl)-3-oxo-1-cyclohexén-1-yl]-4-(4-méthyl-6-oxo-1,4,5,6-tétrahydro-3-pyridazinyl)anilinium [French] [ACD/IUPAC Name]

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

Density:
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 3.21
ACD/LogD (pH 5.5): 4.14
ACD/BCF (pH 5.5): 828.89
ACD/KOC (pH 5.5): 4271.88
ACD/LogD (pH 7.4): 4.14
ACD/BCF (pH 7.4): 829.18
ACD/KOC (pH 7.4): 4273.36
Polar Surface Area: 75 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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