ChemSpider 2D Image | 4-Amino-N'-{(Z)-[2,4-bis(methylsulfonyl)phenyl]methylene}-1,2,5-oxadiazole-3-carbohydrazide | C12H13N5O6S2

4-Amino-N'-{(Z)-[2,4-bis(methylsulfonyl)phenyl]methylene}-1,2,5-oxadiazole-3-carbohydrazide

  • Molecular FormulaC12H13N5O6S2
  • Average mass387.392 Da
  • Monoisotopic mass387.030731 Da
  • ChemSpider ID101764292
  • Double-bond stereo - Double-bond stereo


More details:






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

1,2,5-Oxadiazole-3-carboxylic acid, 4-amino-, 2-[(1Z)-[2,4-bis(methylsulfonyl)phenyl]methylene]hydrazide [ACD/Index Name]
4-Amino-N'-{(Z)-[2,4-bis(methylsulfonyl)phenyl]methylen}-1,2,5-oxadiazol-3-carbohydrazid [German] [ACD/IUPAC Name]
4-Amino-N'-{(Z)-[2,4-bis(methylsulfonyl)phenyl]methylene}-1,2,5-oxadiazole-3-carbohydrazide [ACD/IUPAC Name]
4-Amino-N'-{(Z)-[2,4-bis(méthylsulfonyl)phényl]méthylène}-1,2,5-oxadiazole-3-carbohydrazide [French] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.7±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.705
Molar Refractivity: 88.3±0.5 cm3
#H bond acceptors: 11
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 0.53
ACD/LogD (pH 5.5): 0.09
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 26.48
ACD/LogD (pH 7.4): 0.08
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 26.16
Polar Surface Area: 191 Å2
Polarizability: 35.0±0.5 10-24cm3
Surface Tension: 74.2±7.0 dyne/cm
Molar Volume: 227.0±7.0 cm3

Click to predict properties on the Chemicalize site






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