Chemical Properties of 5-[( E)-Hexylidene]-5H-furan-2-one

InChI

InChI=1S/C9H12O2/c1-2-3-4-5-8-6-7-9(10)11-8/h5-7H,2-4H2,1H3/b8-5+

InChI Key

ICHISWQVYXYNPA-VMPITWQZSA-N

Formula

C9H12O2

SMILES

CCCCC=C1C=CC(=O)O1

Molecular Weight¹

152.19

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I_np : Non-polar retention indices.
• I : Polar retention indices.
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfusH°	22.04	kJ/mol	Joback Calculated Property
logPoct/wat	2.173		Crippen Calculated Property
McVol	125.650	ml/mol	McGowan Calculated Property
Inp	[1424.00; 1424.00]
Inp	1424.00		NIST
Inp	1424.00		NIST
I	[2211.00; 2211.00]
I	2211.00		NIST
I	2211.00		NIST

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, 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	[270.30; 332.84]	J/mol×K	[480.95; 673.22]
Cp,gas	270.30	J/mol×K	480.95	Joback Calculated Property
Cp,gas	282.35	J/mol×K	512.99	Joback Calculated Property
Cp,gas	293.71	J/mol×K	545.04	Joback Calculated Property
Cp,gas	304.40	J/mol×K	577.08	Joback Calculated Property
Cp,gas	314.46	J/mol×K	609.13	Joback Calculated Property
Cp,gas	323.93	J/mol×K	641.17	Joback Calculated Property
Cp,gas	332.84	J/mol×K	673.22	Joback Calculated Property
η	[0.0003483; 0.0020857]	Pa×s	[266.82; 480.95]
η	0.0020857	Pa×s	266.82	Joback Calculated Property
η	0.0012980	Pa×s	302.51	Joback Calculated Property
η	0.0008928	Pa×s	338.20	Joback Calculated Property
η	0.0006596	Pa×s	373.88	Joback Calculated Property
η	0.0005137	Pa×s	409.57	Joback Calculated Property
η	0.0004164	Pa×s	445.26	Joback Calculated Property
η	0.0003483	Pa×s	480.95	Joback Calculated Property

Similar Compounds

Find more compounds similar to 5-[( E)-Hexylidene]-5H-furan-2-one.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
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