ChemSpider 2D Image | 4-{(Z)-(Hydroxyimino)[2-methyl-4-(4-nitrophenyl)-1-piperazinyl]methyl}-1,2,5-oxadiazol-3-amine | C14H17N7O4

4-{(Z)-(Hydroxyimino)[2-methyl-4-(4-nitrophenyl)-1-piperazinyl]methyl}-1,2,5-oxadiazol-3-amine

  • Molecular FormulaC14H17N7O4
  • Average mass347.329 Da
  • Monoisotopic mass347.134216 Da
  • ChemSpider ID21514698

  • Double-bond stereo - Double-bond stereo

More details:

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

4-{(Z)-(Hydroxyimino)[2-methyl-4-(4-nitrophenyl)-1-piperazinyl]methyl}-1,2,5-oxadiazol-3-amin [German] [ACD/IUPAC Name]
4-{(Z)-(Hydroxyimino)[2-methyl-4-(4-nitrophenyl)-1-piperazinyl]methyl}-1,2,5-oxadiazol-3-amine [ACD/IUPAC Name]
4-{(Z)-(Hydroxyimino)[2-méthyl-4-(4-nitrophényl)-1-pipérazinyl]méthyl}-1,2,5-oxadiazol-3-amine [French] [ACD/IUPAC Name]
Methanone, (4-amino-1,2,5-oxadiazol-3-yl)[2-methyl-4-(4-nitrophenyl)-1-piperazinyl]-, oxime, (Z)- [ACD/Index Name]
(4-Amino-furazan-3-yl)-[2-methyl-4-(4-nitro-phenyl)-piperazin-1-yl]-methanone oxime
4-{(hydroxyimino)[2-methyl-4-(4-nitrophenyl)-1-piperazinyl]methyl}-1,2,5-oxadiazol-3-amine [ACD/IUPAC Name]
4-{(Z)-(hydroxyimino)[2-methyl-4-(4-nitrophenyl)piperazin-1-yl]methyl}-1,2,5-oxadiazol-3-amine

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

Density: 1.6±0.1 g/cm3
Boiling Point: 619.3±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 96.5±3.0 kJ/mol
Flash Point: 328.4±34.3 °C
Index of Refraction: 1.742
Molar Refractivity: 86.1±0.5 cm3
#H bond acceptors: 11
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 3.30
ACD/LogD (pH 5.5): 1.90
ACD/BCF (pH 5.5): 16.28
ACD/KOC (pH 5.5): 256.40
ACD/LogD (pH 7.4): 1.90
ACD/BCF (pH 7.4): 16.28
ACD/KOC (pH 7.4): 256.43
Polar Surface Area: 150 Å2
Polarizability: 34.1±0.5 10-24cm3
Surface Tension: 75.3±7.0 dyne/cm
Molar Volume: 213.2±7.0 cm3

Click to predict properties on the Chemicalize site


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