ChemSpider 2D Image | 4-(5-Amino-1H-indazol-3-yl)benzonitrile | C14H10N4

4-(5-Amino-1H-indazol-3-yl)benzonitrile

  • Molecular FormulaC14H10N4
  • Average mass234.256 Da
  • Monoisotopic mass234.090546 Da
  • ChemSpider ID26529132

More details:

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

1356087-74-5 [RN]
4-(5-Amino-1H-indazol-3-yl)benzonitril [German] [ACD/IUPAC Name]
4-(5-Amino-1H-indazol-3-yl)benzonitrile [ACD/IUPAC Name]
4-(5-Amino-1H-indazol-3-yl)benzonitrile [French] [ACD/IUPAC Name]
Benzonitrile, 4-(5-amino-1H-indazol-3-yl)- [ACD/Index Name]
MFCD21604804 [MDL number]

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

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

Density: 1.4±0.1 g/cm3
Boiling Point: 554.7±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 83.6±3.0 kJ/mol
Flash Point: 289.2±27.3 °C
Index of Refraction: 1.746
Molar Refractivity: 68.9±0.4 cm3
#H bond acceptors: 4
#H bond donors: 3
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.87
ACD/LogD (pH 5.5): 1.91
ACD/BCF (pH 5.5): 16.51
ACD/KOC (pH 5.5): 258.53
ACD/LogD (pH 7.4): 1.91
ACD/BCF (pH 7.4): 16.60
ACD/KOC (pH 7.4): 259.95
Polar Surface Area: 78 Å2
Polarizability: 27.3±0.5 10-24cm3
Surface Tension: 84.5±5.0 dyne/cm
Molar Volume: 169.8±5.0 cm3

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