Chemical Properties of 1,2,4,5-tetraoxacyclohexane, 3,3,6,6-tetrapropyl

InChI

InChI=1S/C14H28O4/c1-5-9-13(10-6-2)15-17-14(11-7-3,12-8-4)18-16-13/h5-12H2,1-4H3

InChI Key

RNUOEHJMGLWQPM-UHFFFAOYSA-N

Formula

C14H28O4

SMILES

CCCC1(CCC)OOC(CCC)(CCC)OO1

Molecular Weight¹

260.37

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• 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
ΔfG°	-271.72	kJ/mol	Joback Calculated Property
ΔfH°gas	-795.83	kJ/mol	Joback Calculated Property
ΔfusH°	44.24	kJ/mol	Joback Calculated Property
ΔvapH°	62.62	kJ/mol	Joback Calculated Property
log10WS	-5.12		Crippen Calculated Property
logPoct/wat	4.489		Crippen Calculated Property
McVol	220.740	ml/mol	McGowan Calculated Property
Pc	1832.54	kPa	Joback Calculated Property
Inp	[1516.30; 1545.20]
Inp	1533.30		NIST
Inp	Outlier 1516.30		NIST
Inp	1533.40		NIST
Inp	1543.40		NIST
Inp	1545.20		NIST
Inp	1541.50		NIST
Inp	1541.60		NIST
Inp	1533.30		NIST
Inp	1541.50		NIST
Tboil	642.88	K	Joback Calculated Property
Tc	840.21	K	Joback Calculated Property
Tfus	404.76	K	Joback Calculated Property
Vc	0.832	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[639.07; 743.66]	J/mol×K	[642.88; 840.21]
Cp,gas	639.07	J/mol×K	642.88	Joback Calculated Property
Cp,gas	657.94	J/mol×K	675.77	Joback Calculated Property
Cp,gas	676.03	J/mol×K	708.66	Joback Calculated Property
Cp,gas	693.51	J/mol×K	741.55	Joback Calculated Property
Cp,gas	710.50	J/mol×K	774.43	Joback Calculated Property
Cp,gas	727.17	J/mol×K	807.32	Joback Calculated Property
Cp,gas	743.66	J/mol×K	840.21	Joback Calculated Property

Similar Compounds

Find more compounds similar to 1,2,4,5-tetraoxacyclohexane, 3,3,6,6-tetrapropyl.

Sources

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

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Outlier This icon means that the value is more than 2 standard deviations away from the property mean.