ChemSpider 2D Image | 1-Allyl-2-[2,5-difluoro-4-(trifluoromethyl)benzyl]guanidine | C12H12F5N3

1-Allyl-2-[2,5-difluoro-4-(trifluoromethyl)benzyl]guanidine

  • Molecular FormulaC12H12F5N3
  • Average mass293.236 Da
  • Monoisotopic mass293.095123 Da
  • ChemSpider ID57766216

More details:

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

1-Allyl-2-[2,5-difluor-4-(trifluormethyl)benzyl]guanidin [German] [ACD/IUPAC Name]
1-Allyl-2-[2,5-difluoro-4-(trifluoromethyl)benzyl]guanidine [ACD/IUPAC Name]
1-Allyl-2-[2,5-difluoro-4-(trifluorométhyl)benzyl]guanidine [French] [ACD/IUPAC Name]
Guanidine, N''-[[2,5-difluoro-4-(trifluoromethyl)phenyl]methyl]-N-2-propen-1-yl- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 317.6±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 55.9±3.0 kJ/mol
Flash Point: 145.9±30.7 °C
Index of Refraction: 1.478
Molar Refractivity: 63.0±0.5 cm3
#H bond acceptors: 3
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.56
ACD/LogD (pH 5.5): 0.57
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 5.95
ACD/LogD (pH 7.4): 0.63
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 6.84
Polar Surface Area: 50 Å2
Polarizability: 25.0±0.5 10-24cm3
Surface Tension: 29.3±7.0 dyne/cm
Molar Volume: 222.5±7.0 cm3

Click to predict properties on the Chemicalize site


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