Chemical Properties of Dichloroacetic acid, 2,7-dimethyloct-7-en-5-yn-4-yl

Dichloroacetic acid, 2,7-dimethyloct-7-en-5-yn-4-yl

InChI
InChI=1S/C12H16Cl2O2/c1-8(2)5-6-10(7-9(3)4)16-12(15)11(13)14/h9-11H,1,7H2,2-4H3
InChI Key
VSXCBHKTNKYJJP-UHFFFAOYSA-N
Formula
C12H16Cl2O2
SMILES
C=C(C)C#CC(CC(C)C)OC(=O)C(Cl)Cl
Molecular Weight1
263.16
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Physical Properties

Property Value Unit Source
Δfus 27.98 kJ/mol Joback Calculated Property
logPoct/wat 3.328 Crippen Calculated Property
McVol 198.960 ml/mol McGowan Calculated Property
Inp [1482.00; 1482.00]   Show Hide
Inp 1482.00 NIST
Inp 1482.00 NIST

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Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [465.05; 538.03] J/mol×K [629.35; 845.58] Show Hide
Cp,gas 465.05 J/mol×K 629.35 Joback Calculated Property
Cp,gas 479.20 J/mol×K 665.39 Joback Calculated Property
Cp,gas 492.53 J/mol×K 701.43 Joback Calculated Property
Cp,gas 505.05 J/mol×K 737.46 Joback Calculated Property
Cp,gas 516.79 J/mol×K 773.50 Joback Calculated Property
Cp,gas 527.78 J/mol×K 809.54 Joback Calculated Property
Cp,gas 538.03 J/mol×K 845.58 Joback Calculated Property

Similar Compounds

Trichloroacetic acid, 2,7-dimethyloct-7-en-5-yn-4-yl ester. Dichloroacetic acid, 2-methyloct-5-yn-4-yl ester. Butanoic acid, 2,7-dimethyloct-7-en-5-yn-4-yl ester. 3-Cloropropionic acid, 2,7-dimethyloct-7-en-5-yn-4-yl ester. Acetoxyacetic acid, 2,7-dimethyloct-7-en-5-yn-4-yl ester. 2,2-Dimethylpropanoic acid, 2,7-dimethyloct-7-en-5-yn-4-yl ester. Valeric acid, 2,7-dimethyloct-7-en-5-yn-4-yl ester. Glutaric acid, di(2,7-dimethyloct-5-yn-7-en-4-yl) ester. 3-Methyl-2-butenoic acid, 2,7-dimethyloct-7-en-5-yn-4-yl ester. Cyclopropanecarboxylic acid, 2,7-dimethyloct-7-en-5-yn-4-yl ester. 4-Bromobutanoic acid, 2,7-dimethyloct-7-en-5-yn-4-yl ester. Hexanoic acid, 2,7-dimethyloct-7-en-5-yn-4-yl ester. Octanoic acid, 2,7-dimethyloct-7-en-5-yn-4-yl ester. Sebacic acid, di(2,7-dimethylocta-7-en-5-yn-4-yl) ester. 5-Bromovaleric acid, 2,7-dimethyloct-7-en-5-yn-4-yl ester.

Find more compounds similar to Dichloroacetic acid, 2,7-dimethyloct-7-en-5-yn-4-yl.

Sources

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