Found 1 result

Search term: KKLIGDMMHXOCFL (Found by InChIKey (skeleton match))

ChemSpider 2D Image | N-(3,4-Dimethoxybenzyl)-2-[2-(3-methoxy-4-nitro-1H-pyrazol-1-yl)propanoyl]hydrazinecarboxamide | C17H22N6O7

N-(3,4-Dimethoxybenzyl)-2-[2-(3-methoxy-4-nitro-1H-pyrazol-1-yl)propanoyl]hydrazinecarboxamide

  • Molecular FormulaC17H22N6O7
  • Average mass422.393 Da
  • Monoisotopic mass422.154999 Da
  • ChemSpider ID102153769

More details:






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

1H-Pyrazole-1-acetic acid, 3-methoxy-α-methyl-4-nitro-, 2-[[[(3,4-dimethoxyphenyl)methyl]amino]carbonyl]hydrazide [ACD/Index Name]
N-(3,4-Dimethoxybenzyl)-2-[2-(3-methoxy-4-nitro-1H-pyrazol-1-yl)propanoyl]hydrazincarboxamid [German] [ACD/IUPAC Name]
N-(3,4-Dimethoxybenzyl)-2-[2-(3-methoxy-4-nitro-1H-pyrazol-1-yl)propanoyl]hydrazinecarboxamide [ACD/IUPAC Name]
N-(3,4-Diméthoxybenzyl)-2-[2-(3-méthoxy-4-nitro-1H-pyrazol-1-yl)propanoyl]hydrazinecarboxamide [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.615
Molar Refractivity: 102.8±0.5 cm3
#H bond acceptors: 13
#H bond donors: 3
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 0.83
ACD/LogD (pH 5.5): 0.58
ACD/BCF (pH 5.5): 1.63
ACD/KOC (pH 5.5): 49.29
ACD/LogD (pH 7.4): 0.57
ACD/BCF (pH 7.4): 1.60
ACD/KOC (pH 7.4): 48.62
Polar Surface Area: 162 Å2
Polarizability: 40.7±0.5 10-24cm3
Surface Tension: 54.0±7.0 dyne/cm
Molar Volume: 294.6±7.0 cm3

Click to predict properties on the Chemicalize site






Advertisement