Chemical Properties of Glutaric acid, di((2-methylcyclohex-1-enyl)methyl) ester

InChI

InChI=1S/C21H32O4/c1-16-8-3-5-10-18(16)14-24-20(22)12-7-13-21(23)25-15-19-11-6-4-9-17(19)2/h3-15H2,1-2H3

InChI Key

WORXIMRANCBTAC-UHFFFAOYSA-N

Formula

C21H32O4

SMILES

CC1=C(COC(=O)CCCC(=O)OCC2=C(C)CCCC2)CCCC1

Molecular Weight¹

348.48

• 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
ΔfG°	-256.18	kJ/mol	Joback Calculated Property
ΔfH°gas	-747.37	kJ/mol	Joback Calculated Property
ΔfusH°	38.14	kJ/mol	Joback Calculated Property
ΔvapH°	85.36	kJ/mol	Joback Calculated Property
log10WS	-5.83		Crippen Calculated Property
logPoct/wat	5.024		Crippen Calculated Property
McVol	291.310	ml/mol	McGowan Calculated Property
Pc	1419.71	kPa	Joback Calculated Property
Inp	[2610.00; 2610.00]
Inp	2610.00		NIST
Inp	2610.00		NIST
Tboil	899.14	K	Joback Calculated Property
Tc	1118.28	K	Joback Calculated Property
Tfus	545.59	K	Joback Calculated Property
Vc	1.099	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[956.50; 1036.41]	J/mol×K	[899.14; 1118.28]
Cp,gas	956.50	J/mol×K	899.14	Joback Calculated Property
Cp,gas	973.53	J/mol×K	935.66	Joback Calculated Property
Cp,gas	989.04	J/mol×K	972.19	Joback Calculated Property
Cp,gas	1003.05	J/mol×K	1008.71	Joback Calculated Property
Cp,gas	1015.60	J/mol×K	1045.23	Joback Calculated Property
Cp,gas	1026.71	J/mol×K	1081.76	Joback Calculated Property
Cp,gas	1036.41	J/mol×K	1118.28	Joback Calculated Property
η	[0.0000357; 0.0004059]	Pa×s	[545.59; 899.14]
η	0.0004059	Pa×s	545.59	Joback Calculated Property
η	0.0002222	Pa×s	604.51	Joback Calculated Property
η	0.0001354	Pa×s	663.44	Joback Calculated Property
η	0.0000895	Pa×s	722.37	Joback Calculated Property
η	0.0000629	Pa×s	781.29	Joback Calculated Property
η	0.0000465	Pa×s	840.21	Joback Calculated Property
η	0.0000357	Pa×s	899.14	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, di((2-methylcyclohex-1-enyl)methyl) ester.

Sources

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

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