Chemical Properties of Glutaric acid, hex-4-yn-3-yl 4-acetylphenyl ester

Glutaric acid, hex-4-yn-3-yl 4-acetylphenyl ester

InChI
InChI=1S/C19H22O5/c1-4-7-16(5-2)23-18(21)8-6-9-19(22)24-17-12-10-15(11-13-17)14(3)20/h10-13,16H,5-6,8-9H2,1-3H3
InChI Key
GTJOMMMYQCQVKR-UHFFFAOYSA-N
Formula
C19H22O5
SMILES
CC#CC(CC)OC(=O)CCCC(=O)Oc1ccc(C(C)=O)cc1
Molecular Weight1
330.38
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Physical Properties

Property Value Unit Source
Δfus 48.55 kJ/mol Joback Calculated Property
logPoct/wat 3.310 Crippen Calculated Property
McVol 262.660 ml/mol McGowan Calculated Property
Inp [2555.00; 2555.00]   Show Hide
Inp 2555.00 NIST
Inp 2555.00 NIST

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Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [772.88; 836.39] J/mol×K [844.85; 1063.07] Show Hide
Cp,gas 772.88 J/mol×K 844.85 Joback Calculated Property
Cp,gas 786.63 J/mol×K 881.22 Joback Calculated Property
Cp,gas 799.10 J/mol×K 917.59 Joback Calculated Property
Cp,gas 810.28 J/mol×K 953.96 Joback Calculated Property
Cp,gas 820.21 J/mol×K 990.33 Joback Calculated Property
Cp,gas 828.91 J/mol×K 1026.70 Joback Calculated Property
Cp,gas 836.39 J/mol×K 1063.07 Joback Calculated Property

Similar Compounds

Glutaric acid, but-3-yn-2-yl 4-acetylphenyl ester. Glutaric acid, 3-methylbut-2-yl 4-acetylphenyl ester. Glutaric acid, 2-methylpent-3-yl 4-acetylphenyl ester. Glutaric acid, dec-2-yl 4-acetylphenyl ester. Glutaric acid, tridec-2-yn-1-yl 4-acetylphenyl ester. Glutaric acid, hex-4-yn-3-yl 3-ethylphenyl ester. Glutaric acid, 1,1,1-trifluoroprop-2-yl 4-acetylphenyl ester. Glutaric acid, hex-4-yn-3-yl 2-ethylphenyl ester. Glutaric acid, hex-4-yn-3-yl 4-bromophenyl ester. Glutaric acid, hex-4-yn-3-yl 3-fluorophenyl ester. Glutaric acid, 4-acetylphenyl isobutyl ester. Glutaric acid, hex-4-yn-3-yl 3-methylphenyl ester. Glutaric acid, 4-acetylphenyl propyl ester. Glutaric acid, 4-acetylphenyl butyl ester. Glutaric acid, 4-acetylphenyl isohexyl ester.

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

Sources

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