ChemSpider 2D Image | Dimethyl N-({2-[(3-nitro-1H-1,2,4-triazol-1-yl)acetyl]hydrazino}carbonothioyl)glutamate | C12H17N7O7S

Dimethyl N-({2-[(3-nitro-1H-1,2,4-triazol-1-yl)acetyl]hydrazino}carbonothioyl)glutamate

  • Molecular FormulaC12H17N7O7S
  • Average mass403.371 Da
  • Monoisotopic mass403.091003 Da
  • ChemSpider ID102419861

More details:

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

Dimethyl N-({2-[(3-nitro-1H-1,2,4-triazol-1-yl)acetyl]hydrazino}carbonothioyl)glutamate [ACD/IUPAC Name]
Dimethyl-N-({2-[(3-nitro-1H-1,2,4-triazol-1-yl)acetyl]hydrazino}carbonothioyl)glutamat [German] [ACD/IUPAC Name]
Glutamic acid, N-[[2-[2-(3-nitro-1H-1,2,4-triazol-1-yl)acetyl]hydrazinyl]thioxomethyl]-, dimethyl ester [ACD/Index Name]
N-({2-[2-(3-Nitro-1H-1,2,4-triazol-1-yl)acétyl]hydrazino}carbonothioyl)glutamate de diméthyle [French] [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: 1.666
Molar Refractivity: 92.5±0.5 cm3
#H bond acceptors: 14
#H bond donors: 3
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 1
ACD/LogP: -0.77
ACD/LogD (pH 5.5): -0.88
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 7.86
ACD/LogD (pH 7.4): -0.96
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 6.59
Polar Surface Area: 214 Å2
Polarizability: 36.7±0.5 10-24cm3
Surface Tension: 66.5±7.0 dyne/cm
Molar Volume: 248.7±7.0 cm3

Click to predict properties on the Chemicalize site


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