Chemical Properties of Glutaric acid, hex-4-yn-3-yl 2,3,5-trichlorophenyl ester

Glutaric acid, hex-4-yn-3-yl 2,3,5-trichlorophenyl ester

InChI
InChI=1S/C17H17Cl3O4/c1-3-6-12(4-2)23-15(21)7-5-8-16(22)24-14-10-11(18)9-13(19)17(14)20/h9-10,12H,4-5,7-8H2,1-2H3
InChI Key
KJGIIBMDVDPJGP-UHFFFAOYSA-N
Formula
C17H17Cl3O4
SMILES
CC#CC(CC)OC(=O)CCCC(=O)Oc1cc(Cl)cc(Cl)c1Cl
Molecular Weight1
391.67
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Physical Properties

Property Value Unit Source
ΔfusH° 53.59 kJ/mol Joback Calculated Property
logPoct/wat 5.068 Crippen Calculated Property
McVol 269.630 ml/mol McGowan Calculated Property
Inp [2587.00; 2587.00]   Show Hide
Inp 2587.00 NIST
Inp 2587.00 NIST

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Correlations

Property Value Unit Temperature (K) Source
Cp,gas [372.19; 749.17] 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 A1.01794e+02
Coefficient B1.12834e+00
Coefficient C-5.14140e-04
Coefficient D3.31800e-08
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 372.19 J/mol×K 273.00 Calculated Property
Cp,gas 438.10 J/mol×K 353.78 Calculated Property
Cp,gas 497.75 J/mol×K 434.56 Calculated Property
Cp,gas 551.27 J/mol×K 515.33 Calculated Property
Cp,gas 598.74 J/mol×K 596.11 Calculated Property
Cp,gas 640.28 J/mol×K 676.89 Calculated Property
Cp,gas 675.98 J/mol×K 757.67 Calculated Property
Cp,gas 705.97 J/mol×K 838.44 Calculated Property
Cp,gas 730.33 J/mol×K 919.22 Calculated Property
Cp,gas 749.17 J/mol×K 1000.00 Calculated Property

Similar Compounds

Glutaric acid, hex-4-yn-3-yl 2,4,5-trichlorophenyl ester. Glutaric acid, hex-4-yn-3-yl 2,3-dichlorophenyl ester. Glutaric acid, hex-4-yn-3-yl 2,5-dichlorophenyl ester. Glutaric acid, hex-4-yn-3-yl 2,4-dichlorophenyl ester. Glutaric acid, hex-4-yn-3-yl 3-chlorophenyl ester. Glutaric acid, hex-4-yn-3-yl 2,6-dichlorophenyl ester. Succinic acid, hex-4-yn-3-yl 2,4,5-trichlorophenyl ester. Glutaric acid, hex-4-yn-3-yl 2-chloro-5-methylphenyl ester. Glutaric acid, but-3-yn-2-yl 2,3,5-trichlorophenyl ester. Glutaric acid, dec-2-yl 2,3,5-trichlorophenyl ester. Glutaric acid, hept-2-yl 2,3,5-trichlorophenyl ester. Glutaric acid, hex-4-yn-3-yl 2,4-dichloro-1-naphthyl ester. Glutaric acid, 3-methylbut-2-yl 2,3,5-trichlorophenyl ester. Glutaric acid, hex-4-yn-3-yl 4-chloro-2-methoxyphenyl ester. Glutaric acid, hex-4-yn-3-yl 2-chloro-6-fluorophenyl ester.

Find more compounds similar to Glutaric acid, hex-4-yn-3-yl 2,3,5-trichlorophenyl ester.

Sources

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