Found 828 results

Search term: MF = 'C_{12}H_{11}F_{3}O_{4}'
ChemSpider 2D Image | 5-Oxo-5-[3-(trifluoromethoxy)phenyl]pentanoic acid | C12H11F3O4

5-Oxo-5-[3-(trifluoromethoxy)phenyl]pentanoic acid

  • Molecular FormulaC12H11F3O4
  • Average mass276.208 Da
  • Monoisotopic mass276.060944 Da
  • ChemSpider ID35326557

More details:

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

1443340-28-0 [RN]
5-Oxo-5-[3-(trifluormethoxy)phenyl]pentansäure [German] [ACD/IUPAC Name]
5-Oxo-5-[3-(trifluoromethoxy)phenyl]pentanoic acid [ACD/IUPAC Name]
Acide 5-oxo-5-[3-(trifluorométhoxy)phényl]pentanoïque [French] [ACD/IUPAC Name]
Benzenepentanoic acid, δ-oxo-3-(trifluoromethoxy)- [ACD/Index Name]
5-[3-(Trifluoromethoxy)phenyl]-5-oxovaleric acid
5-Oxo-5-(3-(trifluoromethoxy)phenyl)pentanoic acid
atoms 19 bonds 19
MFCD22370284

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

Density: 1.3±0.1 g/cm3
Boiling Point: 369.6±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 65.0±3.0 kJ/mol
Flash Point: 177.4±27.9 °C
Index of Refraction: 1.485
Molar Refractivity: 58.9±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.70
ACD/LogD (pH 5.5): 1.30
ACD/BCF (pH 5.5): 3.36
ACD/KOC (pH 5.5): 43.92
ACD/LogD (pH 7.4): -0.50
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 64 Å2
Polarizability: 23.3±0.5 10-24cm3
Surface Tension: 39.1±3.0 dyne/cm
Molar Volume: 205.5±3.0 cm3

Click to predict properties on the Chemicalize site


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