Chemical Properties of Glutaric acid, tridec-2-yn-1-yl 2-methyl-4-chlorophenyl ester

Glutaric acid, tridec-2-yn-1-yl 2-methyl-4-chlorophenyl ester

InChI
InChI=1S/C25H35ClO4/c1-3-4-5-6-7-8-9-10-11-12-13-19-29-24(27)15-14-16-25(28)30-23-18-17-22(26)20-21(23)2/h17-18,20H,3-11,14-16,19H2,1-2H3
InChI Key
ZHSMQLVHNAFJMA-UHFFFAOYSA-N
Formula
C25H35ClO4
SMILES
CCCCCCCCCCC#CCOC(=O)CCCC(=O)Oc1ccc(Cl)cc1C
Molecular Weight1
435.00
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Physical Properties

Property Value Unit Source
Δfus 69.83 kJ/mol Joback Calculated Property
logPoct/wat 6.802 Crippen Calculated Property
McVol 357.870 ml/mol McGowan Calculated Property
Inp [3207.00; 3207.00]   Show Hide
Inp 3207.00 NIST
Inp 3207.00 NIST

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Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [1136.09; 1202.72] J/mol×K [971.11; 1190.26] Show Hide
Cp,gas 1136.09 J/mol×K 971.11 Joback Calculated Property
Cp,gas 1150.81 J/mol×K 1007.63 Joback Calculated Property
Cp,gas 1164.04 J/mol×K 1044.16 Joback Calculated Property
Cp,gas 1175.80 J/mol×K 1080.68 Joback Calculated Property
Cp,gas 1186.14 J/mol×K 1117.21 Joback Calculated Property
Cp,gas 1195.10 J/mol×K 1153.73 Joback Calculated Property
Cp,gas 1202.72 J/mol×K 1190.26 Joback Calculated Property

Similar Compounds

Glutaric acid, tridec-2-yn-1-yl 2-methylphenyl ester. Glutaric acid, tridec-2-yn-1-yl 2,3-dimethylphenyl ester. Glutaric acid, 2-methyl-4-chlorophenyl undecyl ester. Glutaric acid, 2-methyl-4-chlorophenyl tetradecyl ester. Glutaric acid, 2-methyl-4-chlorophenyl pentadecyl ester. Glutaric acid, 2-methyl-4-chlorophenyl octyl ester. Glutaric acid, hexadecyl 2-methyl-4-chlorophenyl ester. Glutaric acid, dodecyl 2-methyl-4-chlorophenyl ester. Glutaric acid, heptyl 2-methyl-4-chlorophenyl ester. Glutaric acid, hexyl 2-methyl-4-chlorophenyl ester. Glutaric acid, 2-methyl-4-chlorophenyl pentyl ester. Glutaric acid, tridec-2-yn-1-yl 2-chloro-5-methylphenyl ester. Sebacic acid, butyl 4-chloro-2-methylphenyl ester. Sebacic acid, 4-chloro-2-methylphenyl undecyl ester. Sebacic acid, 4-chloro-2-methylphenyl heptyl ester.

Find more compounds similar to Glutaric acid, tridec-2-yn-1-yl 2-methyl-4-chlorophenyl ester.

Sources

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