ChemSpider 2D Image | Ethyl 2-chloro-3-(trifluoromethyl)benzoate | C10H8ClF3O2

Ethyl 2-chloro-3-(trifluoromethyl)benzoate

  • Molecular FormulaC10H8ClF3O2
  • Average mass252.617 Da
  • Monoisotopic mass252.016495 Da
  • ChemSpider ID21429392

More details:

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

2-Chloro-3-(trifluorométhyl)benzoate d'éthyle [French] [ACD/IUPAC Name]
Benzoic acid, 2-chloro-3-(trifluoromethyl)-, ethyl ester [ACD/Index Name]
Ethyl 2-chloro-3-(trifluoromethyl)benzoate [ACD/IUPAC Name]
Ethyl-2-chlor-3-(trifluormethyl)benzoat [German] [ACD/IUPAC Name]
2-Chloro-3-(trifluoromethyl)benzoic acid ethyl ester
2-Chloro-3-trifluoromethyl ethyl benzoate
2-chloro-3-trifluoromethyl-benzoic acid ethyl ester
2-Chloro-3-trifluoromethylbenzoic acid ethyl ester
773135-43-6 [RN]
MFCD06204506

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

CCRIS 4693 [DBID]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 269.3±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 50.7±3.0 kJ/mol
Flash Point: 103.7±16.5 °C
Index of Refraction: 1.467
Molar Refractivity: 52.5±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.21
ACD/LogD (pH 5.5): 3.80
ACD/BCF (pH 5.5): 453.67
ACD/KOC (pH 5.5): 2775.24
ACD/LogD (pH 7.4): 3.80
ACD/BCF (pH 7.4): 453.67
ACD/KOC (pH 7.4): 2775.24
Polar Surface Area: 26 Å2
Polarizability: 20.8±0.5 10-24cm3
Surface Tension: 30.5±3.0 dyne/cm
Molar Volume: 189.3±3.0 cm3

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