Chemical Properties of 1,2,4,5,7,8-hexaoxacyclononane, 3,3,6,6-tetramethyl, 9,9-diethyl

InChI

InChI=1S/C11H22O6/c1-7-11(8-2)16-14-9(3,4)12-13-10(5,6)15-17-11/h7-8H2,1-6H3

InChI Key

DEAVANREEHNQGL-UHFFFAOYSA-N

Formula

C11H22O6

SMILES

CCC1(CC)OOC(C)(C)OOC(C)(C)OO1

Molecular Weight¹

250.29

• 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°	-518.72	kJ/mol	Joback Calculated Property
ΔfH°gas	-1021.49	kJ/mol	Joback Calculated Property
ΔfusH°	40.90	kJ/mol	Joback Calculated Property
ΔvapH°	64.01	kJ/mol	Joback Calculated Property
log10WS	-3.64		Crippen Calculated Property
logPoct/wat	2.833		Crippen Calculated Property
McVol	190.210	ml/mol	McGowan Calculated Property
Pc	2553.34	kPa	Joback Calculated Property
Inp	[1257.10; 1275.70]
Inp	Outlier 1257.10		NIST
Inp	1273.10		NIST
Inp	1268.80		NIST
Inp	1270.40		NIST
Inp	1275.70		NIST
Inp	1270.90		NIST
Inp	1269.50		NIST
Tboil	636.52	K	Joback Calculated Property
Tc	867.83	K	Joback Calculated Property
Tfus	433.19	K	Joback Calculated Property
Vc	0.678	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[551.86; 660.55]	J/mol×K	[636.52; 867.83]
Cp,gas	551.86	J/mol×K	636.52	Joback Calculated Property
Cp,gas	570.88	J/mol×K	675.07	Joback Calculated Property
Cp,gas	589.16	J/mol×K	713.62	Joback Calculated Property
Cp,gas	606.99	J/mol×K	752.18	Joback Calculated Property
Cp,gas	624.64	J/mol×K	790.73	Joback Calculated Property
Cp,gas	642.40	J/mol×K	829.28	Joback Calculated Property
Cp,gas	660.55	J/mol×K	867.83	Joback Calculated Property

Similar Compounds

Find more compounds similar to 1,2,4,5,7,8-hexaoxacyclononane, 3,3,6,6-tetramethyl, 9,9-diethyl.

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.