ChemSpider 2D Image | 3-(5-Cyclopropyl-2H-tetrazol-2-yl)-1,1,1-trifluoro-2-propanol | C7H9F3N4O

3-(5-Cyclopropyl-2H-tetrazol-2-yl)-1,1,1-trifluoro-2-propanol

  • Molecular FormulaC7H9F3N4O
  • Average mass222.168 Da
  • Monoisotopic mass222.072845 Da
  • ChemSpider ID35200300

More details:

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

2H-Tetrazole-2-ethanol, 5-cyclopropyl-α-(trifluoromethyl)- [ACD/Index Name]
3-(5-Cyclopropyl-2H-tetrazol-2-yl)-1,1,1-trifluor-2-propanol [German] [ACD/IUPAC Name]
3-(5-Cyclopropyl-2H-tetrazol-2-yl)-1,1,1-trifluoro-2-propanol [ACD/IUPAC Name]
3-(5-Cyclopropyl-2H-tétrazol-2-yl)-1,1,1-trifluoro-2-propanol [French] [ACD/IUPAC Name]

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

Density: 1.8±0.1 g/cm3
Boiling Point: 361.4±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 64.1±3.0 kJ/mol
Flash Point: 172.3±30.7 °C
Index of Refraction: 1.621
Molar Refractivity: 43.8±0.5 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.51
ACD/LogD (pH 5.5): 0.40
ACD/BCF (pH 5.5): 1.18
ACD/KOC (pH 5.5): 39.14
ACD/LogD (pH 7.4): 0.40
ACD/BCF (pH 7.4): 1.18
ACD/KOC (pH 7.4): 39.14
Polar Surface Area: 64 Å2
Polarizability: 17.4±0.5 10-24cm3
Surface Tension: 48.9±7.0 dyne/cm
Molar Volume: 124.6±7.0 cm3

Click to predict properties on the Chemicalize site


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