Chemical Properties of Oxirane, 2,3-diethyl- (CAS 4468-66-0)

InChI

InChI=1S/C6H12O/c1-3-5-6(4-2)7-5/h5-6H,3-4H2,1-2H3

InChI Key

PCGTXZMDZGOMJG-UHFFFAOYSA-N

Formula

C6H12O

SMILES

CCC1OC1CC

Molecular Weight¹

100.16

CAS

4468-66-0

Other Names

• Hexane, 3,4-epoxy-
• 3,4-Epoxyhexane
• 2,3-Diethyloxirane

• Δ_cH°_liquid : Standard liquid enthalpy of combustion (kJ/mol).
• 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.
• T_boil : Normal Boiling Point Temperature (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔcH°liquid	-3818.00	kJ/mol	NIST
ΔfusH°	18.48	kJ/mol	Joback Calculated Property
logPoct/wat	1.574		Crippen Calculated Property
McVol	90.410	ml/mol	McGowan Calculated Property
Inp	[744.00; 751.00]
Inp	744.00		NIST
Inp	751.00		NIST
Inp	749.00		NIST
Inp	744.00		NIST
Inp	749.00		NIST
Tboil	379.00 ± 2.50	K	NIST

Cheméo can also estimate 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	[170.05; 234.59]	J/mol×K	[365.70; 545.29]
Cp,gas	170.05	J/mol×K	365.70	Joback Calculated Property
Cp,gas	182.12	J/mol×K	395.63	Joback Calculated Property
Cp,gas	193.64	J/mol×K	425.56	Joback Calculated Property
Cp,gas	204.63	J/mol×K	455.49	Joback Calculated Property
Cp,gas	215.10	J/mol×K	485.43	Joback Calculated Property
Cp,gas	225.08	J/mol×K	515.36	Joback Calculated Property
Cp,gas	234.59	J/mol×K	545.29	Joback Calculated Property
η	[0.0003506; 0.0007706]	Pa×s	[197.65; 365.70]
η	0.0007706	Pa×s	197.65	Joback Calculated Property
η	0.0006229	Pa×s	225.66	Joback Calculated Property
η	0.0005278	Pa×s	253.67	Joback Calculated Property
η	0.0004621	Pa×s	281.68	Joback Calculated Property
η	0.0004145	Pa×s	309.68	Joback Calculated Property
η	0.0003786	Pa×s	337.69	Joback Calculated Property
η	0.0003506	Pa×s	365.70	Joback Calculated Property

Similar Compounds

Find more compounds similar to Oxirane, 2,3-diethyl-.

Sources

• 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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