Found 182 results

Search term: MF = 'C_{8}H_{5}N_{5}'
ChemSpider 2D Image | 3-(1H-Tetrazol-1-yl)benzonitrile | C8H5N5

3-(1H-Tetrazol-1-yl)benzonitrile

  • Molecular FormulaC8H5N5
  • Average mass171.159 Da
  • Monoisotopic mass171.054489 Da
  • ChemSpider ID26460548

More details:

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

3-(1H-Tetrazol-1-yl)benzonitril [German] [ACD/IUPAC Name]
3-(1H-Tetrazol-1-yl)benzonitrile [ACD/IUPAC Name]
3-(1H-Tétrazol-1-yl)benzonitrile [French] [ACD/IUPAC Name]
Benzonitrile, 3-(1H-tetrazol-1-yl)- [ACD/Index Name]
1291486-07-1 [RN]
3-(1,2,3,4-tetraazolyl)benzenecarbonitrile
3-(1H-1,2,3,4-tetrazol-1-yl)benzonitrile
3-(1H-Tetraazol-1-yl)benzonitrile
MFCD23703718

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

Density: 1.4±0.1 g/cm3
Boiling Point: 366.7±44.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 61.3±3.0 kJ/mol
Flash Point: 175.6±28.4 °C
Index of Refraction: 1.712
Molar Refractivity: 49.3±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.53
ACD/LogD (pH 5.5): 0.52
ACD/BCF (pH 5.5): 1.47
ACD/KOC (pH 5.5): 45.94
ACD/LogD (pH 7.4): 0.52
ACD/BCF (pH 7.4): 1.47
ACD/KOC (pH 7.4): 45.94
Polar Surface Area: 67 Å2
Polarizability: 19.6±0.5 10-24cm3
Surface Tension: 62.4±7.0 dyne/cm
Molar Volume: 126.0±7.0 cm3

Click to predict properties on the Chemicalize site


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