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_fG° : Standard Gibbs free energy of formation (kJ/mol).
• 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).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• P_c : Critical Pressure (kPa).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔcH°liquid	-3818.00	kJ/mol	NIST
ΔfG°	-33.44	kJ/mol	Joback Calculated Property
ΔfH°gas	-246.71	kJ/mol	Joback Calculated Property
ΔfusH°	18.48	kJ/mol	Joback Calculated Property
ΔvapH°	33.06	kJ/mol	Joback Calculated Property
log10WS	-1.54		Crippen Calculated Property
logPoct/wat	1.574		Crippen Calculated Property
McVol	90.410	ml/mol	McGowan Calculated Property
Pc	3435.91	kPa	Joback 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
Tc	545.29	K	Joback Calculated Property
Tfus	197.65	K	Joback Calculated Property
Vc	0.348	m3/kmol	Joback Calculated Property

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

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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