Chemical Properties of (2,3,5,6-Tetrafluorophenyl)methyl 3-(2,2-dichlorovinyl)-2,2-dimethyl-cyclopropane-1-carboxylate (CAS 118712-89-3)

InChI

InChI=1S/C15H12Cl2F4O2/c1-15(2)7(3-10(16)17)11(15)14(22)23-5-6-12(20)8(18)4-9(19)13(6)21/h3-4,7,11H,5H2,1-2H3

InChI Key

DDVNRFNDOPPVQJ-UHFFFAOYSA-N

Formula

C15H12Cl2F4O2

SMILES

CC1(C)C(C=C(Cl)Cl)C1C(=O)OCc1c(F)c(F)cc(F)c1F

Molecular Weight¹

371.15

CAS

118712-89-3

Other Names

• Cyclopropanecarboxylic acid, 3-(2,2-dichloroethenyl)-2,2-dimethyl-, (2,3,5,6-tetrafluorophenyl)methyl ester
• Bayothrin
• Transfluthrin

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I_np : Non-polar retention indices.
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Normal Boiling Point Temperature, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[315.88; 684.97]	J/mol×K	[273.00; 1000.00]	Joback Predicted correlation
Equation			Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K
Coefficient A			-1.41290e+01
Coefficient B			1.52764e+00
Coefficient C			-1.29514e-03
Coefficient D			4.66600e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	315.88	J/mol×K	273.00	Calculated Property
Cp,gas	384.88	J/mol×K	353.78	Calculated Property
Cp,gas	443.43	J/mol×K	434.56	Calculated Property
Cp,gas	493.02	J/mol×K	515.33	Calculated Property
Cp,gas	535.13	J/mol×K	596.11	Calculated Property
Cp,gas	571.22	J/mol×K	676.89	Calculated Property
Cp,gas	602.77	J/mol×K	757.67	Calculated Property
Cp,gas	631.27	J/mol×K	838.44	Calculated Property
Cp,gas	658.17	J/mol×K	919.22	Calculated Property
Cp,gas	684.97	J/mol×K	1000.00	Calculated Property

Similar Compounds

Find more compounds similar to (2,3,5,6-Tetrafluorophenyl)methyl 3-(2,2-dichlorovinyl)-2,2-dimethyl-cyclopropane-1-carboxylate.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
Calculated This icon marks a calculated value or equation: a prediction, not a measurement.
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