ChemSpider 2D Image | 1,1,1-Trifluoro-3-(3,4,5-trimethoxyphenyl)-2-propanamine | C12H16F3NO3

1,1,1-Trifluoro-3-(3,4,5-trimethoxyphenyl)-2-propanamine

  • Molecular FormulaC12H16F3NO3
  • Average mass279.255 Da
  • Monoisotopic mass279.108215 Da
  • ChemSpider ID63001037

More details:

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

1,1,1-Trifluor-3-(3,4,5-trimethoxyphenyl)-2-propanamin [German] [ACD/IUPAC Name]
1,1,1-Trifluoro-3-(3,4,5-trimethoxyphenyl)-2-propanamine [ACD/IUPAC Name]
1,1,1-Trifluoro-3-(3,4,5-triméthoxyphényl)-2-propanamine [French] [ACD/IUPAC Name]
Benzeneethanamine, 3,4,5-trimethoxy-α-(trifluoromethyl)- [ACD/Index Name]
1,1,1-trifluoro-3-(3,4,5-trimethoxyphenyl)propan-2-amine
21161-87-5 [RN]
MFCD16615953

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

Density: 1.2±0.1 g/cm3
Boiling Point: 335.4±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 57.8±3.0 kJ/mol
Flash Point: 156.6±27.9 °C
Index of Refraction: 1.469
Molar Refractivity: 64.4±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.11
ACD/LogD (pH 5.5): 1.53
ACD/BCF (pH 5.5): 7.83
ACD/KOC (pH 5.5): 136.99
ACD/LogD (pH 7.4): 1.68
ACD/BCF (pH 7.4): 11.20
ACD/KOC (pH 7.4): 195.88
Polar Surface Area: 54 Å2
Polarizability: 25.5±0.5 10-24cm3
Surface Tension: 30.6±3.0 dyne/cm
Molar Volume: 231.2±3.0 cm3

Click to predict properties on the Chemicalize site


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