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

Benzeneacetic acid, 4-chloro-, hex-4-yn-3-yl ester

InChI
InChI=1S/C14H15ClO2/c1-3-5-13(4-2)17-14(16)10-11-6-8-12(15)9-7-11/h6-9,13H,4,10H2,1-2H3
InChI Key
XFDDAQZNPQCVJV-UHFFFAOYSA-N
Formula
C14H15ClO2
SMILES
CC#CC(CC)OC(=O)Cc1ccc(Cl)cc1
Molecular Weight1
250.72
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Physical Properties

Property Value Unit Source
ΔfusH° 32.25 kJ/mol Joback Calculated Property
logPoct/wat 3.228 Crippen Calculated Property
McVol 195.440 ml/mol McGowan Calculated Property
Inp [1801.00; 1801.00]   Show Hide
Inp 1801.00 NIST
Inp 1801.00 NIST

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Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [479.46; 553.96] J/mol×K [673.66; 905.18] Show Hide
Cp,gas 479.46 J/mol×K 673.66 Joback Calculated Property
Cp,gas 494.26 J/mol×K 712.25 Joback Calculated Property
Cp,gas 508.08 J/mol×K 750.83 Joback Calculated Property
Cp,gas 520.93 J/mol×K 789.42 Joback Calculated Property
Cp,gas 532.84 J/mol×K 828.00 Joback Calculated Property
Cp,gas 543.84 J/mol×K 866.59 Joback Calculated Property
Cp,gas 553.96 J/mol×K 905.18 Joback Calculated Property

Similar Compounds

Phenylacetic acid, hex-4-yn-3-yl ester. Benzeneacetic acid, 4-chloro-, 2-methyloct-5-yn-4-yl ester. Benzeneacetic acid, 4-nitro-, hex-4-yn-3-yl ester. Benzeneacetic acid, 4-chloro-, 2,7-dimethyloct-1-en-3-yn-5-yl ester. Phenylacetic acid, 2-methyloct-5-yn-4-yl ester. Benzeneacetic acid, 4-chloro-, tridec-2-yn-1-yl ester. Phenylacetic acid, 4-chloro-, butyl ester. Hydratropic acid, hex-4-yn-3-yl ester. Phenylacetic acid, 4-chloro-, octyl ester. Phenylacetic acid, 4-chloro-, tetradecyl ester. Phenylacetic acid, 4-chloro-, undecyl ester. Phenylacetic acid, 4-chloro-, pentadecyl ester. Phenylacetic acid, 4-chloro-, nonyl ester. Phenylacetic acid, 4-chloro-, heptadecyl ester. Phenylacetic acid, 4-chloro-, tridecyl ester.

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

Sources

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