ChemSpider 2D Image | N-(3-Chlorophenyl)-4-nitro-2,1,3-benzoxadiazol-5-amine | C12H7ClN4O3

N-(3-Chlorophenyl)-4-nitro-2,1,3-benzoxadiazol-5-amine

  • Molecular FormulaC12H7ClN4O3
  • Average mass290.662 Da
  • Monoisotopic mass290.020660 Da
  • ChemSpider ID29394494

More details:

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

2,1,3-Benzoxadiazol-5-amine, N-(3-chlorophenyl)-4-nitro- [ACD/Index Name]
N-(3-Chlorophenyl)-4-nitro-2,1,3-benzoxadiazol-5-amine [ACD/IUPAC Name]
N-(3-Chlorophényl)-4-nitro-2,1,3-benzoxadiazol-5-amine [French] [ACD/IUPAC Name]
N-(3-Chlorphenyl)-4-nitro-2,1,3-benzoxadiazol-5-amin [German] [ACD/IUPAC Name]
1422955-24-5 [RN]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 448.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 70.8±3.0 kJ/mol
Flash Point: 225.3±31.5 °C
Index of Refraction: 1.737
Molar Refractivity: 73.4±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.77
ACD/LogD (pH 5.5): 3.93
ACD/BCF (pH 5.5): 574.72
ACD/KOC (pH 5.5): 3287.18
ACD/LogD (pH 7.4): 3.93
ACD/BCF (pH 7.4): 574.72
ACD/KOC (pH 7.4): 3287.18
Polar Surface Area: 97 Å2
Polarizability: 29.1±0.5 10-24cm3
Surface Tension: 75.4±3.0 dyne/cm
Molar Volume: 182.6±3.0 cm3

Click to predict properties on the Chemicalize site


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