Found 3172 results

Search term: MF = 'C_{12}H_{12}F_{3}NO_{2}'
ChemSpider 2D Image | 1-[4-(Trifluoromethyl)phenyl]-3-pyrrolidinecarboxylic acid | C12H12F3NO2

1-[4-(Trifluoromethyl)phenyl]-3-pyrrolidinecarboxylic acid

  • Molecular FormulaC12H12F3NO2
  • Average mass259.224 Da
  • Monoisotopic mass259.082001 Da
  • ChemSpider ID22547556

More details:

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

1-[4-(Trifluormethyl)phenyl]-3-pyrrolidincarbonsäure [German] [ACD/IUPAC Name]
1-[4-(Trifluoromethyl)phenyl]-3-pyrrolidinecarboxylic acid [ACD/IUPAC Name]
3-Pyrrolidinecarboxylic acid, 1-[4-(trifluoromethyl)phenyl]- [ACD/Index Name]
Acide 1-[4-(trifluorométhyl)phényl]-3-pyrrolidinecarboxylique [French] [ACD/IUPAC Name]
1-(4-(Trifluoromethyl)phenyl)pyrrolidine-3-carboxylic acid
1-[4-(trifluoromethyl)phenyl]pyrrolidine-3-carboxylic acid
1086374-97-1 [RN]
MFCD09864928 [MDL number]
TS-03472

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

Density: 1.4±0.1 g/cm3
Boiling Point: 382.3±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 66.5±3.0 kJ/mol
Flash Point: 185.0±27.9 °C
Index of Refraction: 1.519
Molar Refractivity: 57.5±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.55
ACD/LogD (pH 5.5): 1.38
ACD/BCF (pH 5.5): 3.47
ACD/KOC (pH 5.5): 39.58
ACD/LogD (pH 7.4): -0.41
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 41 Å2
Polarizability: 22.8±0.5 10-24cm3
Surface Tension: 42.0±3.0 dyne/cm
Molar Volume: 189.7±3.0 cm3

Click to predict properties on the Chemicalize site


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