ChemSpider 2D Image | 3,3,3-Trifluoro-2-(mesitylmethyl)propanoic acid | C13H15F3O2

3,3,3-Trifluoro-2-(mesitylmethyl)propanoic acid

  • Molecular FormulaC13H15F3O2
  • Average mass260.252 Da
  • Monoisotopic mass260.102417 Da
  • ChemSpider ID32037671

More details:

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

1219921-41-1 [RN]
3,3,3-Trifluor-2-(mesitylmethyl)propansäure [German] [ACD/IUPAC Name]
3,3,3-Trifluoro-2-(mesitylmethyl)propanoic acid [ACD/IUPAC Name]
3,3,3-trifluoro-2-[(2,4,6-trimethylphenyl)methyl]propanoic acid
Acide 3,3,3-trifluoro-2-(mésitylméthyl)propanoïque [French] [ACD/IUPAC Name]
Benzenepropanoic acid, 2,4,6-trimethyl-α-(trifluoromethyl)- [ACD/Index Name]
MFCD22578687

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

Density: 1.2±0.1 g/cm3
Boiling Point: 325.3±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 59.9±3.0 kJ/mol
Flash Point: 150.5±27.9 °C
Index of Refraction: 1.483
Molar Refractivity: 61.5±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.83
ACD/LogD (pH 5.5): 1.53
ACD/BCF (pH 5.5): 2.42
ACD/KOC (pH 5.5): 14.83
ACD/LogD (pH 7.4): 0.18
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 37 Å2
Polarizability: 24.4±0.5 10-24cm3
Surface Tension: 33.7±3.0 dyne/cm
Molar Volume: 215.5±3.0 cm3

Click to predict properties on the Chemicalize site


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