ChemSpider 2D Image | 2,2-Difluoro-4-(1H-tetrazol-1-yl)-1-butanol | C5H8F2N4O

2,2-Difluoro-4-(1H-tetrazol-1-yl)-1-butanol

  • Molecular FormulaC5H8F2N4O
  • Average mass178.140 Da
  • Monoisotopic mass178.066620 Da
  • ChemSpider ID65475134

More details:

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

1H-Tetrazole-1-butanol, β,β-difluoro- [ACD/Index Name]
2,2-Difluor-4-(1H-tetrazol-1-yl)-1-butanol [German] [ACD/IUPAC Name]
2,2-Difluoro-4-(1H-tetrazol-1-yl)-1-butanol [ACD/IUPAC Name]
2,2-Difluoro-4-(1H-tétrazol-1-yl)-1-butanol [French] [ACD/IUPAC Name]
2,2-difluoro-4-(1H-1,2,3,4-tetrazol-1-yl)butan-1-ol
2229082-79-3 [RN]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 333.1±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 60.8±3.0 kJ/mol
Flash Point: 155.3±30.7 °C
Index of Refraction: 1.545
Molar Refractivity: 37.3±0.5 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -0.32
ACD/LogD (pH 5.5): -0.23
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 17.83
ACD/LogD (pH 7.4): -0.23
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 17.84
Polar Surface Area: 64 Å2
Polarizability: 14.8±0.5 10-24cm3
Surface Tension: 45.9±7.0 dyne/cm
Molar Volume: 117.9±7.0 cm3

Click to predict properties on the Chemicalize site


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