ChemSpider 2D Image | (3-{[(2-Methyl-4-nitro-1H-imidazol-1-yl)acetyl]amino}-1H-pyrazol-1-yl)acetic acid | C11H12N6O5

(3-{[(2-Methyl-4-nitro-1H-imidazol-1-yl)acetyl]amino}-1H-pyrazol-1-yl)acetic acid

  • Molecular FormulaC11H12N6O5
  • Average mass308.250 Da
  • Monoisotopic mass308.086914 Da
  • ChemSpider ID54340617

More details:

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

(3-{[(2-Methyl-4-nitro-1H-imidazol-1-yl)acetyl]amino}-1H-pyrazol-1-yl)acetic acid [ACD/IUPAC Name]
(3-{[(2-Methyl-4-nitro-1H-imidazol-1-yl)acetyl]amino}-1H-pyrazol-1-yl)essigsäure [German] [ACD/IUPAC Name]
1H-Pyrazole-1-acetic acid, 3-[[2-(2-methyl-4-nitro-1H-imidazol-1-yl)acetyl]amino]- [ACD/Index Name]
Acide (3-{[2-(2-méthyl-4-nitro-1H-imidazol-1-yl)acétyl]amino}-1H-pyrazol-1-yl)acétique [French] [ACD/IUPAC Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 739.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 113.2±3.0 kJ/mol
Flash Point: 401.2±31.5 °C
Index of Refraction: 1.723
Molar Refractivity: 73.2±0.5 cm3
#H bond acceptors: 11
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: -0.43
ACD/LogD (pH 5.5): -2.46
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.97
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 148 Å2
Polarizability: 29.0±0.5 10-24cm3
Surface Tension: 79.6±7.0 dyne/cm
Molar Volume: 184.8±7.0 cm3

Click to predict properties on the Chemicalize site


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