Chemical Properties of 3(2H)-Furanone, 2-hexyl-5-methyl- (CAS 33922-66-6)

3(2H)-Furanone, 2-hexyl-5-methyl-

InChI
InChI=1S/C11H18O2/c1-3-4-5-6-7-11-10(12)8-9(2)13-11/h8,11H,3-7H2,1-2H3
InChI Key
AAUWBAWSKVOBFL-UHFFFAOYSA-N
Formula
C11H18O2
SMILES
CCCCCCC1OC(C)=CC1=O
Molecular Weight1
182.26
CAS
33922-66-6
Other Names
  • 2-Hexyl-5-methyl-3(2H)-furanone
  • 2,3-Dihydro-2-n-hexyl-5-methyl-furan-3-one
  • 2,3-Dihydro-5-methyl-2-n-hexylfuran-3-one
  • 2-Hexyl-5-methyl-2(3H)-furan-3-one
  • 2-Hexyl-5-methyl-(2H)-furan-3-one
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Physical Properties

Property Value Unit Source
ΔfH°gas -411.79 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 26.50 kJ/mol Joback Calculated Property
ΔvapH° 67.24 kJ/mol Relay (1.0) Calculated Property
IE 9.00 eV Relay (1.0) Calculated Property
logPoct/wat 2.828 Crippen Calculated Property
McVol 158.130 ml/mol McGowan Calculated Property

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, 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 [400.16; 488.02] J/mol×K [565.47; 769.88] Show Hide
Cp,gas 400.16 J/mol×K 565.47 Joback Calculated Property
Cp,gas 416.73 J/mol×K 599.54 Joback Calculated Property
Cp,gas 432.52 J/mol×K 633.61 Joback Calculated Property
Cp,gas 447.54 J/mol×K 667.67 Joback Calculated Property
Cp,gas 461.80 J/mol×K 701.74 Joback Calculated Property
Cp,gas 475.29 J/mol×K 735.81 Joback Calculated Property
Cp,gas 488.02 J/mol×K 769.88 Joback Calculated Property

Similar Compounds

2,3-dihydro-2-decyl-5-methylfuran-3-one. 3(2H)-FURANONE, 5-METHYL-2-OCTYL-. (Z)-6-Methyl-2-(tricos-14-en-1-yl)-2H-pyran-4(3H)-one. (Z)-6-Methyl-2-(nonadec-10-en-1-yl)-2H-pyran-4(3H)-one. (Z)-2-(henicos-12-en-1-yl)-6-methyl-2H-pyran-4(3H)-one. Ethanone, 1-(3,4-dihydro-6-methyl-2H-pyran-2-yl)-. 5-Pregnen-3«beta»-ol-20-one, hexanoate. Pregnenolone palmitate. 5-Pregnen-3«beta»-ol-20-one, butyrate. 1.beta.-acetoxyfurano-3-eudesmene. 6,6-Ethylene testosterone 17-cyclopenten-1'-yl ether. Androst-5-en-16-one, 3,17-bis[(trifluoroacetyl)oxy]-, (3«beta»,17«beta»)-. 1«beta»-acetoxyfurano-4(15)-eudesmene. 6Alpha,21-diacetoxy-11beta,17alpha-dihydroxypregn-4-ene-3,20-dione. 11Beta,17alpha-dihydroxy-2alpha,21-diacetoxypregna-4-ene-3,20-dione.

Find more compounds similar to 3(2H)-Furanone, 2-hexyl-5-methyl-.

Sources

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