ChemSpider 2D Image | 4-Nitro-2,1,3-benzoxadiazol-5-olate | C6H2N3O4

4-Nitro-2,1,3-benzoxadiazol-5-olate

  • Molecular FormulaC6H2N3O4
  • Average mass180.098 Da
  • Monoisotopic mass180.005081 Da
  • ChemSpider ID77408307

  • Charge - Charge

More details:

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

2,1,3-Benzoxadiazol-5-ol, 4-nitro-, ion(1-) [ACD/Index Name]
4-Nitro-2,1,3-benzoxadiazol-5-olat [German] [ACD/IUPAC Name]
4-Nitro-2,1,3-benzoxadiazol-5-olate [ACD/IUPAC Name]
4-Nitro-2,1,3-benzoxadiazol-5-olate [French] [ACD/IUPAC Name]

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

Density:
Boiling Point: 319.7±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 58.4±3.0 kJ/mol
Flash Point: 147.1±28.7 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 1.18
ACD/LogD (pH 5.5): -0.38
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.31
ACD/LogD (pH 7.4): -1.64
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 108 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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