Chemical Properties of 1,2-Cyclohexanedicarboxylic acid, 4-methyl, dimethyl ester

InChI

InChI=1S/C11H18O4/c1-7-4-5-8(10(12)14-2)9(6-7)11(13)15-3/h7-9H,4-6H2,1-3H3

InChI Key

GADRQTDSMCWRTB-UHFFFAOYSA-N

Formula

C11H18O4

SMILES

COC(=O)C1CCC(C)CC1C(=O)OC

Molecular Weight¹

214.26

• 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°	-417.07	kJ/mol	Joback Calculated Property
ΔfH°gas	-746.33	kJ/mol	Joback Calculated Property
ΔfusH°	23.80	kJ/mol	Joback Calculated Property
ΔvapH°	58.20	kJ/mol	Joback Calculated Property
log10WS	-1.32		Crippen Calculated Property
logPoct/wat	1.385		Crippen Calculated Property
McVol	169.870	ml/mol	McGowan Calculated Property
Pc	2395.87	kPa	Joback Calculated Property
Inp	[1403.00; 1427.00]
Inp	1403.00		NIST
Inp	1410.00		NIST
Inp	1418.00		NIST
Inp	1427.00		NIST
Tboil	613.87	K	Joback Calculated Property
Tc	821.66	K	Joback Calculated Property
Tfus	356.95	K	Joback Calculated Property
Vc	0.630	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[458.97; 550.52]	J/mol×K	[613.87; 821.66]
Cp,gas	458.97	J/mol×K	613.87	Joback Calculated Property
Cp,gas	476.63	J/mol×K	648.50	Joback Calculated Property
Cp,gas	493.34	J/mol×K	683.13	Joback Calculated Property
Cp,gas	509.10	J/mol×K	717.76	Joback Calculated Property
Cp,gas	523.89	J/mol×K	752.40	Joback Calculated Property
Cp,gas	537.71	J/mol×K	787.03	Joback Calculated Property
Cp,gas	550.52	J/mol×K	821.66	Joback Calculated Property
η	[0.0002444; 0.0018188]	Pa×s	[356.95; 613.87]
η	0.0018188	Pa×s	356.95	Joback Calculated Property
η	0.0010882	Pa×s	399.77	Joback Calculated Property
η	0.0007191	Pa×s	442.59	Joback Calculated Property
η	0.0005113	Pa×s	485.41	Joback Calculated Property
η	0.0003842	Pa×s	528.23	Joback Calculated Property
η	0.0003013	Pa×s	571.05	Joback Calculated Property
η	0.0002444	Pa×s	613.87	Joback Calculated Property

Similar Compounds

Find more compounds similar to 1,2-Cyclohexanedicarboxylic acid, 4-methyl, dimethyl ester.

Sources

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

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