Chemical Properties of 2(3H)-Furanone, 5-dodecyldihydro- (CAS 730-46-1)

InChI

InChI=1S/C16H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-15-13-14-16(17)18-15/h15H,2-14H2,1H3

InChI Key

SRIFJCOBFTWCTM-UHFFFAOYSA-N

Formula

C16H30O2

SMILES

CCCCCCCCCCCCC1CCC(=O)O1

Molecular Weight¹

254.41

CAS

730-46-1

Other Names

• Hexadecanoic acid, 4-hydroxy-, «gamma»-lactone
• «gamma»-Palmitolactone
• «gamma»-Hexadecalactone
• Palmito-«gamma»-lactone

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization 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.
• T_boil : Normal Boiling Point Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfH°gas	-626.30	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	39.70	kJ/mol	Joback Calculated Property
ΔvapH°	97.80	kJ/mol	Relay (1.0) Calculated Property
logPoct/wat	5.003		Crippen Calculated Property
McVol	232.880	ml/mol	McGowan Calculated Property
Inp	[2104.30; 2120.00]
Inp	2106.00		NIST
Inp	2120.00		NIST
Inp	2104.30		NIST
Inp	2104.30		NIST
Inp	2106.00		NIST
I	[2810.00; 2857.00]
I	2810.00		NIST
I	2857.00		NIST
I	2857.00		NIST
I	2857.00		NIST
I	2810.00		NIST
Tboil	621.24	K	Relay (1.0) Calculated Property
Tfus	289.72	K	Relay (1.0) Calculated Property

Cheméo can also estimate 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	[653.98; 752.57]	J/mol×K	[630.64; 804.05]
Cp,gas	653.98	J/mol×K	630.64	Joback Calculated Property
Cp,gas	672.53	J/mol×K	659.54	Joback Calculated Property
Cp,gas	690.20	J/mol×K	688.44	Joback Calculated Property
Cp,gas	707.00	J/mol×K	717.34	Joback Calculated Property
Cp,gas	722.97	J/mol×K	746.24	Joback Calculated Property
Cp,gas	738.15	J/mol×K	775.14	Joback Calculated Property
Cp,gas	752.57	J/mol×K	804.05	Joback Calculated Property
η	[0.0002744; 0.0031398]	Pa×s	[330.35; 630.64]
η	0.0031398	Pa×s	330.35	Joback Calculated Property
η	0.0016012	Pa×s	380.40	Joback Calculated Property
η	0.0009550	Pa×s	430.45	Joback Calculated Property
η	0.0006343	Pa×s	480.49	Joback Calculated Property
η	0.0004551	Pa×s	530.54	Joback Calculated Property
η	0.0003458	Pa×s	580.59	Joback Calculated Property
η	0.0002744	Pa×s	630.64	Joback Calculated Property

Similar Compounds

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

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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