Chemical Properties of Succinic acid, 3-chlorophenyl 1-bromo-3,3,3-trifluoroprop-2-yl ester

Succinic acid, 3-chlorophenyl 1-bromo-3,3,3-trifluoroprop-2-yl ester

InChI
InChI=1S/C13H11BrClF3O4/c14-7-10(13(16,17)18)22-12(20)5-4-11(19)21-9-3-1-2-8(15)6-9/h1-3,6,10H,4-5,7H2
InChI Key
UVNMXASQOXMWOH-UHFFFAOYSA-N
Formula
C13H11BrClF3O4
SMILES
O=C(CCC(=O)OC(CBr)C(F)(F)F)Oc1cccc(Cl)c1
Molecular Weight1
403.58
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Physical Properties

Property Value Unit Source
ΔfusH° 39.60 kJ/mol Joback Calculated Property
IE 9.26 eV Relay (1.0) Calculated Property
logPoct/wat 3.895 Crippen Calculated Property
McVol 220.200 ml/mol McGowan Calculated Property
Inp [2022.00; 2022.00]   Show Hide
Inp 2022.00 NIST
Inp 2022.00 NIST

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Correlations

Property Value Unit Temperature (K) Source
Cp,gas [309.44; 625.22] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A3.54830e+01
Coefficient B1.20290e+00
Coefficient C-7.74360e-04
Coefficient D1.61200e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 309.44 J/mol×K 273.00 Calculated Property
Cp,gas 371.26 J/mol×K 353.78 Calculated Property
Cp,gas 425.21 J/mol×K 434.56 Calculated Property
Cp,gas 471.79 J/mol×K 515.33 Calculated Property
Cp,gas 511.52 J/mol×K 596.11 Calculated Property
Cp,gas 544.91 J/mol×K 676.89 Calculated Property
Cp,gas 572.47 J/mol×K 757.67 Calculated Property
Cp,gas 594.70 J/mol×K 838.44 Calculated Property
Cp,gas 612.11 J/mol×K 919.22 Calculated Property
Cp,gas 625.22 J/mol×K 1000.00 Calculated Property

Similar Compounds

Succinic acid, 2,3-dichlorophenyl 1-bromo-3,3,3-trifluoroprop-2-yl ester. Succinic acid, 1,1,1-trifluoroprop-2-yl 3-chlorophenyl ester. Succinic acid, 2-fluorophenyl 1-bromo-3,3,3-trifluoroprop-2-yl ester. Succinic acid, 1,1,1-trifluoroprop-2-yl 2-chlorophenyl ester. Succinic acid, 2,3-dichlorophenyl 1,1,1-trifluoroprop-2-yl ester. Glutaric acid, 1,1,1-trifluoroprop-2-yl 3-chlorophenyl ester. Succinic acid, 1,1,1-trifluoroprop-2-yl 3,5-dichlorophenyl ester. Succinic acid, 2-chloro-6-fluorophenyl 1-bromo-3,3,3-trifluoroprop-2-yl ester. Succinic acid, 1,1,1-trifluoroprop-2-yl 2,4-dichlorophenyl ester. Succinic acid, 4-chloro-3-methylphenyl 1-bromo-3,3,3-trifluoroprop-2-yl ester. Succinic acid, 1,1,1-trifluoroprop-2-yl 2,4,5-trichlorophenyl ester. Glutaric acid, 1,1,1-trifluoroprop-2-yl 2,3-dichlorophenyl ester. Glutaric acid, 1,1,1-trifluoroprop-2-yl 2-chlorophenyl ester. Succinic acid, but-3-yn-2-yl 3-chlorophenyl ester. Succinic acid, 1,1,1-trifluoroprop-2-yl 4-chloro-2-methoxyphenyl ester.

Find more compounds similar to Succinic acid, 3-chlorophenyl 1-bromo-3,3,3-trifluoroprop-2-yl ester.

Sources

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