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

Glutaric acid, but-3-yn-2-yl 2,3-dimethylphenyl ester

InChI
InChI=1S/C17H20O4/c1-5-13(3)20-16(18)10-7-11-17(19)21-15-9-6-8-12(2)14(15)4/h1,6,8-9,13H,7,10-11H2,2-4H3
InChI Key
ALKXMKZHFVMLJA-UHFFFAOYSA-N
Formula
C17H20O4
SMILES
C#CC(C)OC(=O)CCCC(=O)Oc1cccc(C)c1C
Molecular Weight1
288.34
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Physical Properties

Property Value Unit Source
Δfus 41.24 kJ/mol Joback Calculated Property
logPoct/wat 2.944 Crippen Calculated Property
McVol 232.910 ml/mol McGowan Calculated Property
Inp [2084.00; 2084.00]   Show Hide
Inp 2084.00 NIST
Inp 2084.00 NIST

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Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [642.08; 716.49] J/mol×K [731.32; 940.82] Show Hide
Cp,gas 642.08 J/mol×K 731.32 Joback Calculated Property
Cp,gas 657.14 J/mol×K 766.24 Joback Calculated Property
Cp,gas 671.11 J/mol×K 801.15 Joback Calculated Property
Cp,gas 684.02 J/mol×K 836.07 Joback Calculated Property
Cp,gas 695.87 J/mol×K 870.98 Joback Calculated Property
Cp,gas 706.69 J/mol×K 905.90 Joback Calculated Property
Cp,gas 716.49 J/mol×K 940.82 Joback Calculated Property

Similar Compounds

Succinic acid, but-3-yn-2-yl 2,3-dimethylphenyl ester. Glutaric acid, but-3-yn-2-yl 2-methylphenyl ester. Glutaric acid, 1,1,1-trifluoroprop-2-yl 2,3-dimethylphenyl ester. Glutaric acid, hex-4-yn-3-yl 2,3-dimethylphenyl ester. Glutaric acid, 2,3-dimethylphenyl ethyl ester. Glutaric acid, but-3-yn-2-yl 2-methyl-4-chlorophenyl ester. Glutaric acid, 3-methylbut-2-yl 2,3-dimethylphenyl ester. Glutaric acid, but-3-yn-2-yl 3-methylphenyl ester. Glutaric acid, 2,3-dimethylphenyl propyl ester. Glutaric acid, dec-2-yl 2,3-dimethylphenyl ester. Glutaric acid, hept-2-yl 2,3-dimethylphenyl ester. Glutaric acid, 2,2-dichloroethyl 2,3-dimethylphenyl ester. Glutaric acid, butyl 2,3-dimethylphenyl ester. Glutaric acid, 2,3-dimethylphenyl isobutyl ester. Adipic acid, 2,3-dimethylphenyl ethyl ester.

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

Sources

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