ChemSpider 2D Image | 1-(3,4-Diethoxyphenyl)-2,2,2-trifluoroethanamine | C12H16F3NO2

1-(3,4-Diethoxyphenyl)-2,2,2-trifluoroethanamine

  • Molecular FormulaC12H16F3NO2
  • Average mass263.256 Da
  • Monoisotopic mass263.113312 Da
  • ChemSpider ID24049979

More details:






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

1-(3,4-Diethoxyphenyl)-2,2,2-trifluorethanamin [German] [ACD/IUPAC Name]
1-(3,4-Diethoxyphenyl)-2,2,2-trifluoroethanamine [ACD/IUPAC Name]
1-(3,4-Diéthoxyphényl)-2,2,2-trifluoroéthanamine [French] [ACD/IUPAC Name]
Benzenemethanamine, 3,4-diethoxy-α-(trifluoromethyl)- [ACD/Index Name]
1-(3,4-DIETHOXYPHENYL)-2,2,2-TRIFLUOROETHAN-1-AMINE
MFCD07384610

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 315.9±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 55.7±3.0 kJ/mol
Flash Point: 144.9±27.9 °C
Index of Refraction: 1.469
Molar Refractivity: 62.4±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.76
ACD/LogD (pH 5.5): 1.08
ACD/BCF (pH 5.5): 2.30
ACD/KOC (pH 5.5): 33.96
ACD/LogD (pH 7.4): 1.98
ACD/BCF (pH 7.4): 18.45
ACD/KOC (pH 7.4): 272.95
Polar Surface Area: 44 Å2
Polarizability: 24.7±0.5 10-24cm3
Surface Tension: 30.8±3.0 dyne/cm
Molar Volume: 224.1±3.0 cm3

Click to predict properties on the Chemicalize site






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