ChemSpider 2D Image | 2-{2-Iodo-6-methoxy-4-[(E)-(3-methyl-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene)methyl]phenoxy}-N-phenylacetamide | C26H22IN3O4

2-{2-Iodo-6-methoxy-4-[(E)-(3-methyl-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene)methyl]phenoxy}-N-phenylacetamide

  • Molecular FormulaC26H22IN3O4
  • Average mass567.375 Da
  • Monoisotopic mass567.065491 Da
  • ChemSpider ID81295495

  • Double-bond stereo - Double-bond stereo

More details:

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

2-{2-Iod-6-methoxy-4-[(E)-(3-methyl-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-yliden)methyl]phenoxy}-N-phenylacetamid [German] [ACD/IUPAC Name]
2-{2-Iodo-6-methoxy-4-[(E)-(3-methyl-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene)methyl]phenoxy}-N-phenylacetamide [ACD/IUPAC Name]
2-{2-Iodo-6-méthoxy-4-[(E)-(3-méthyl-5-oxo-1-phényl-1,5-dihydro-4H-pyrazol-4-ylidène)méthyl]phénoxy}-N-phénylacétamide [French] [ACD/IUPAC Name]
Acetamide, 2-[4-[(E)-(1,5-dihydro-3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-ylidene)methyl]-2-iodo-6-methoxyphenoxy]-N-phenyl- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.652
Molar Refractivity: 139.0±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 4.66
ACD/LogD (pH 5.5): 4.41
ACD/BCF (pH 5.5): 1329.28
ACD/KOC (pH 5.5): 5990.75
ACD/LogD (pH 7.4): 4.41
ACD/BCF (pH 7.4): 1329.29
ACD/KOC (pH 7.4): 5990.80
Polar Surface Area: 80 Å2
Polarizability: 55.1±0.5 10-24cm3
Surface Tension: 49.8±7.0 dyne/cm
Molar Volume: 380.3±7.0 cm3

Click to predict properties on the Chemicalize site


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