ChemSpider 2D Image | 4-(Aminooxy)-7-nitro-2,1,3-benzoxadiazole | C6H4N4O4

4-(Aminooxy)-7-nitro-2,1,3-benzoxadiazole

  • Molecular FormulaC6H4N4O4
  • Average mass196.120 Da
  • Monoisotopic mass196.023254 Da
  • ChemSpider ID52321111

More details:

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

2,1,3-Benzoxadiazole, 4-(aminooxy)-7-nitro- [ACD/Index Name]
4-(Aminooxy)-7-nitro-2,1,3-benzoxadiazol [German] [ACD/IUPAC Name]
4-(Aminooxy)-7-nitro-2,1,3-benzoxadiazole [ACD/IUPAC Name]
4-(Aminooxy)-7-nitro-2,1,3-benzoxadiazole [French] [ACD/IUPAC Name]
1360449-26-8 [RN]
MFCD21921307
O-(7-nitro-2,1,3-benzoxadiazol-4-yl)hydroxylamine

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

Density: 1.7±0.1 g/cm3
Boiling Point: 419.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.4±3.0 kJ/mol
Flash Point: 207.7±31.5 °C
Index of Refraction: 1.699
Molar Refractivity: 44.7±0.3 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.17
ACD/LogD (pH 5.5): 0.49
ACD/BCF (pH 5.5): 1.38
ACD/KOC (pH 5.5): 43.92
ACD/LogD (pH 7.4): 0.49
ACD/BCF (pH 7.4): 1.38
ACD/KOC (pH 7.4): 43.92
Polar Surface Area: 120 Å2
Polarizability: 17.7±0.5 10-24cm3
Surface Tension: 88.1±3.0 dyne/cm
Molar Volume: 115.8±3.0 cm3

Click to predict properties on the Chemicalize site


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