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

Acetoxyacetic acid, hex-4-yn-3-yl ester

InChI
InChI=1S/C10H14O4/c1-4-6-9(5-2)14-10(12)7-13-8(3)11/h9H,5,7H2,1-3H3
InChI Key
SRTYDEDBRGXGAT-UHFFFAOYSA-N
Formula
C10H14O4
SMILES
CC#CC(CC)OC(=O)COC(C)=O
Molecular Weight1
198.22
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Physical Properties

Property Value Unit Source
Δfus 29.99 kJ/mol Joback Calculated Property
logPoct/wat 0.895 Crippen Calculated Property
McVol 158.040 ml/mol McGowan Calculated Property
Inp 1319.00 NIST

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Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [369.21; 438.63] J/mol×K [553.40; 752.80] Show Hide
Cp,gas 369.21 J/mol×K 553.40 Joback Calculated Property
Cp,gas 382.41 J/mol×K 586.63 Joback Calculated Property
Cp,gas 394.96 J/mol×K 619.87 Joback Calculated Property
Cp,gas 406.87 J/mol×K 653.10 Joback Calculated Property
Cp,gas 418.12 J/mol×K 686.33 Joback Calculated Property
Cp,gas 428.71 J/mol×K 719.56 Joback Calculated Property
Cp,gas 438.63 J/mol×K 752.80 Joback Calculated Property

Similar Compounds

Succinic acid, hex-4-yn-3-yl 2-methoxyethyl ester. Dichloroacetic acid, hex-4-yn-3-yl ester. Trichloroacetic acid, hex-4-yn-3-yl ester. Acetoxyacetic acid, 2-methyloct-5-yn-4-yl ester. 3-Chloropropionic acid, hex-4-yn-3-yl ester. Butanoic acid, hex-4-yn-3-yl ester. 2,2-Dimethylpropanoic acid, hex-4-yn-3-yl ester. Glutaric acid, ethyl hex-4-yn-3-yl ester. Glutaric acid, hex-4-yn-3-yl propyl ester. Glutaric acid, di(hex-4-yn-3-yl) ester. Glutaric acid, hex-4-yn-3-yl isopropyl ester. Succinic acid, hex-4-yn-3-yl neopentyl ester. Cyclopropanecarboxylic acid, hex-4-yn-3-yl ester. 4-Bromobutanoic acid, hex-4-yn-3-yl ester. valeric acid, hex-4-yn-3-yl ester.

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

Sources

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