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

Glutaric acid, but-3-yn-2-yl 2,3,5-trichlorophenyl ester

InChI
InChI=1S/C15H13Cl3O4/c1-3-9(2)21-13(19)5-4-6-14(20)22-12-8-10(16)7-11(17)15(12)18/h1,7-9H,4-6H2,2H3
InChI Key
ZNUBYHUSZXUVKV-UHFFFAOYSA-N
Formula
C15H13Cl3O4
SMILES
C#CC(C)OC(=O)CCCC(=O)Oc1cc(Cl)cc(Cl)c1Cl
Molecular Weight1
363.62
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Physical Properties

Property Value Unit Source
Δfus 48.26 kJ/mol Joback Calculated Property
logPoct/wat 4.287 Crippen Calculated Property
McVol 241.450 ml/mol McGowan Calculated Property
Inp [2357.00; 2357.00]   Show Hide
Inp 2357.00 NIST
Inp 2357.00 NIST

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Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [605.25; 653.47] J/mol×K [802.83; 1027.99] Show Hide
Cp,gas 605.25 J/mol×K 802.83 Joback Calculated Property
Cp,gas 615.84 J/mol×K 840.36 Joback Calculated Property
Cp,gas 625.39 J/mol×K 877.88 Joback Calculated Property
Cp,gas 633.91 J/mol×K 915.41 Joback Calculated Property
Cp,gas 641.42 J/mol×K 952.94 Joback Calculated Property
Cp,gas 647.93 J/mol×K 990.46 Joback Calculated Property
Cp,gas 653.47 J/mol×K 1027.99 Joback Calculated Property

Similar Compounds

Glutaric acid, 2,3-dichlorophenyl but-3-yn-2-yl ester. Glutaric acid, but-3-yn-2-yl 2,4,5-trichlorophenyl ester. Glutaric acid, but-3-yn-2-yl 2,5-dichlorophenyl ester. Glutaric acid, but-3-yn-2-yl 2,4-dichlorophenyl ester. Glutaric acid, but-3-yn-2-yl 2-chlorophenyl ester. Glutaric acid, ethyl 2,3,5-trichlorophenyl ester. Glutaric acid, 1,1,1-trifluoroprop-2-yl 2,3,5-trichlorophenyl ester. Glutaric acid, but-3-yn-2-yl 3-chlorophenyl ester. Glutaric acid, but-3-yn-2-yl 2,6-dichlorophenyl ester. Glutaric acid, hex-4-yn-3-yl 2,3,5-trichlorophenyl ester. Glutaric acid, propyl 2,3,5-trichlorophenyl ester. Glutaric acid, butyl 2,3,5-trichlorophenyl ester. Adipic acid, ethyl 2,3,5-trichlorophenyl ester. Glutaric acid, 2,4,6-trichlorophenyl but-3-yn-2-yl ester. Glutaric acid, pentyl 2,3,5-trichlorophenyl ester.

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

Sources

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