Chemical Properties of (Z)-Whisky lactone

(Z)-Whisky lactone

InChI
InChI=1S/C9H16O2/c1-3-4-5-8-7(2)6-9(10)11-8/h7-8H,3-6H2,1-2H3
InChI Key
WNVCMFHPRIBNCW-UHFFFAOYSA-N
Formula
C9H16O2
SMILES
CCCCC1OC(=O)CC1C
Molecular Weight1
156.22
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Physical Properties

Property Value Unit Source
ΔfH°gas -484.43 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 22.64 kJ/mol Joback Calculated Property
ΔvapH° 61.68 kJ/mol Relay (1.0) Calculated Property
logPoct/wat 2.128 Crippen Calculated Property
McVol 134.250 ml/mol McGowan Calculated Property
Inp [1134.00; 1134.00]   Show Hide
Inp 1134.00 NIST
Inp 1134.00 NIST
I [1957.00; 1957.00]   Show Hide
I 1957.00 NIST
I 1957.00 NIST

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [303.10; 382.72] J/mol×K [465.81; 649.20] Show Hide
Cp,gas 303.10 J/mol×K 465.81 Joback Calculated Property
Cp,gas 318.04 J/mol×K 496.37 Joback Calculated Property
Cp,gas 332.30 J/mol×K 526.94 Joback Calculated Property
Cp,gas 345.87 J/mol×K 557.50 Joback Calculated Property
Cp,gas 358.79 J/mol×K 588.07 Joback Calculated Property
Cp,gas 371.06 J/mol×K 618.63 Joback Calculated Property
Cp,gas 382.72 J/mol×K 649.20 Joback Calculated Property
η [0.0004246; 0.0018806] Pa×s [247.22; 465.81] Show Hide
η 0.0018806 Pa×s 247.22 Joback Calculated Property
η 0.0012514 Pa×s 283.65 Joback Calculated Property
η 0.0009136 Pa×s 320.08 Joback Calculated Property
η 0.0007113 Pa×s 356.51 Joback Calculated Property
η 0.0005801 Pa×s 392.95 Joback Calculated Property
η 0.0004897 Pa×s 429.38 Joback Calculated Property
η 0.0004246 Pa×s 465.81 Joback Calculated Property

Similar Compounds

Whiskey lactone (5-Butyl-4-methyloxolan-2-one). trans-Wiskey lactone. trans-4-hydroxy-3-methyloctanoic acid lactone. cis-«beta»-Methyl-«gamma»-octalactone. 2(3H)-Furanone, 5-butyldihydro-4-methyl-, cis-. trans-«beta»-Methyl-«gamma»-octalactone. «beta»-Methyl-«gamma»-octalactone. cis-Wiskey lactone. cis-Whisky lactone. 2(3H)-Furanone, 5-butyldihydro-4-methyl-. trans-3-Methyl-4-octanolide. dihydro-4-methyl-5-pentylfuran-2(3H)-one. Hexahydro-3-butylphthalide. Sebacic acid, di(4-methylhept-3-yl) ester. (3R,3aS,6R,7[a]R)-Perhydro-3,6-dimethyl-benzo-[b]-furan-2-one.

Find more compounds similar to (Z)-Whisky lactone.

Sources

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