ChemSpider 2D Image | Methyl 2-{2-bromo-6-methoxy-4-[(Z)-{[(3-methyl-1,2,4-oxadiazol-5-yl)carbonyl]hydrazono}methyl]phenoxy}propanoate | C16H17BrN4O6

Methyl 2-{2-bromo-6-methoxy-4-[(Z)-{[(3-methyl-1,2,4-oxadiazol-5-yl)carbonyl]hydrazono}methyl]phenoxy}propanoate

  • Molecular FormulaC16H17BrN4O6
  • Average mass441.233 Da
  • Monoisotopic mass440.033142 Da
  • ChemSpider ID100297208

  • Double-bond stereo - Double-bond stereo

More details:

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

1,2,4-Oxadiazole-5-carboxylic acid, 3-methyl-, 2-[(1Z)-[3-bromo-5-methoxy-4-(2-methoxy-1-methyl-2-oxoethoxy)phenyl]methylene]hydrazide [ACD/Index Name]
2-{2-Bromo-6-méthoxy-4-[(Z)-{[(3-méthyl-1,2,4-oxadiazol-5-yl)carbonyl]hydrazono}méthyl]phénoxy}propanoate de méthyle [French] [ACD/IUPAC Name]
Methyl 2-{2-bromo-6-methoxy-4-[(Z)-{[(3-methyl-1,2,4-oxadiazol-5-yl)carbonyl]hydrazono}methyl]phenoxy}propanoate [ACD/IUPAC Name]
Methyl-2-{2-brom-6-methoxy-4-[(Z)-{[(3-methyl-1,2,4-oxadiazol-5-yl)carbonyl]hydrazono}methyl]phenoxy}propanoat [German] [ACD/IUPAC Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.609
Molar Refractivity: 97.5±0.5 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 1.93
ACD/LogD (pH 5.5): 1.83
ACD/BCF (pH 5.5): 14.45
ACD/KOC (pH 5.5): 235.40
ACD/LogD (pH 7.4): 1.83
ACD/BCF (pH 7.4): 14.36
ACD/KOC (pH 7.4): 233.91
Polar Surface Area: 125 Å2
Polarizability: 38.6±0.5 10-24cm3
Surface Tension: 48.5±7.0 dyne/cm
Molar Volume: 281.5±7.0 cm3

Click to predict properties on the Chemicalize site


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