ChemSpider 2D Image | Methyl 6-{[(2-{5-[(4-nitro-1H-pyrazol-1-yl)methyl]-2-furoyl}hydrazino)carbonyl]amino}hexanoate | C17H22N6O7

Methyl 6-{[(2-{5-[(4-nitro-1H-pyrazol-1-yl)methyl]-2-furoyl}hydrazino)carbonyl]amino}hexanoate

  • Molecular FormulaC17H22N6O7
  • Average mass422.393 Da
  • Monoisotopic mass422.154999 Da
  • ChemSpider ID102156241

More details:






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

2-Furancarboxylic acid, 5-[(4-nitro-1H-pyrazol-1-yl)methyl]-, 2-[[(6-methoxy-6-oxohexyl)amino]carbonyl]hydrazide [ACD/Index Name]
6-{[(2-{5-[(4-Nitro-1H-pyrazol-1-yl)méthyl]-2-furoyl}hydrazino)carbonyl]amino}hexanoate de méthyle [French] [ACD/IUPAC Name]
Methyl 6-{[(2-{5-[(4-nitro-1H-pyrazol-1-yl)methyl]-2-furoyl}hydrazino)carbonyl]amino}hexanoate [ACD/IUPAC Name]
Methyl-6-{[(2-{5-[(4-nitro-1H-pyrazol-1-yl)methyl]-2-furoyl}hydrazino)carbonyl]amino}hexanoat [German] [ACD/IUPAC 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: 1.632
Molar Refractivity: 102.8±0.5 cm3
#H bond acceptors: 13
#H bond donors: 3
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 1
ACD/LogP: -0.08
ACD/LogD (pH 5.5): 0.53
ACD/BCF (pH 5.5): 1.48
ACD/KOC (pH 5.5): 46.11
ACD/LogD (pH 7.4): 0.52
ACD/BCF (pH 7.4): 1.47
ACD/KOC (pH 7.4): 45.75
Polar Surface Area: 173 Å2
Polarizability: 40.7±0.5 10-24cm3
Surface Tension: 61.8±7.0 dyne/cm
Molar Volume: 288.0±7.0 cm3

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