ChemSpider 2D Image | Methyl 6-amino-5-nitro-3-pyridazinecarboxylate | C6H6N4O4

Methyl 6-amino-5-nitro-3-pyridazinecarboxylate

  • Molecular FormulaC6H6N4O4
  • Average mass198.136 Da
  • Monoisotopic mass198.038910 Da
  • ChemSpider ID28534846

More details:

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

1379171-16-0 [RN]
3-Pyridazinecarboxylic acid, 6-amino-5-nitro-, methyl ester [ACD/Index Name]
6-Amino-5-nitro-3-pyridazinecarboxylate de méthyle [French] [ACD/IUPAC Name]
Methyl 6-amino-5-nitro-3-pyridazinecarboxylate [ACD/IUPAC Name]
Methyl 6-amino-5-nitropyridazine-3-carboxylate
Methyl-6-amino-5-nitro-3-pyridazincarboxylat [German] [ACD/IUPAC Name]
104685-75-8 [RN]
3-Methoxy-2-nitroaniline [ACD/IUPAC Name]
methyl 6-amino-5-nitropyridine-3-carboxylate
Methyl6-amino-5-nitropyridazine-3-carboxylate
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.5±0.1 g/cm3
Boiling Point: 522.6±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 79.6±3.0 kJ/mol
Flash Point: 269.9±28.7 °C
Index of Refraction: 1.621
Molar Refractivity: 45.0±0.3 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.91
ACD/LogD (pH 5.5): 1.31
ACD/BCF (pH 5.5): 5.87
ACD/KOC (pH 5.5): 123.48
ACD/LogD (pH 7.4): 1.31
ACD/BCF (pH 7.4): 5.87
ACD/KOC (pH 7.4): 123.48
Polar Surface Area: 124 Å2
Polarizability: 17.8±0.5 10-24cm3
Surface Tension: 79.4±3.0 dyne/cm
Molar Volume: 127.9±3.0 cm3

Click to predict properties on the Chemicalize site


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