ChemSpider 2D Image | 2,2'-[(5-Nitro-2-pyrimidinyl)imino]diacetic acid | C8H8N4O6

2,2'-[(5-Nitro-2-pyrimidinyl)imino]diacetic acid

  • Molecular FormulaC8H8N4O6
  • Average mass256.172 Da
  • Monoisotopic mass256.044373 Da
  • ChemSpider ID43278997

More details:

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

2,2'-[(5-Nitro-2-pyrimidinyl)imino]diacetic acid [ACD/IUPAC Name]
2,2'-[(5-Nitro-2-pyrimidinyl)imino]diessigsäure [German] [ACD/IUPAC Name]
Acide 2,2'-[(5-nitro-2-pyrimidinyl)imino]diacétique [French] [ACD/IUPAC Name]
Glycine, N-(carboxymethyl)-N-(5-nitro-2-pyrimidinyl)- [ACD/Index 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: 600.8±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 94.0±3.0 kJ/mol
Flash Point: 317.1±34.3 °C
Index of Refraction: 1.676
Molar Refractivity: 55.7±0.3 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 0.43
ACD/LogD (pH 5.5): -2.00
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.51
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 149 Å2
Polarizability: 22.1±0.5 10-24cm3
Surface Tension: 107.3±3.0 dyne/cm
Molar Volume: 148.0±3.0 cm3

Click to predict properties on the Chemicalize site


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