Chemical Properties of 1,2-Cyclohexanedicarboxylic acid, 2-methylpent-3-yl octadecyl ester

InChI

InChI=1S/C32H60O4/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-23-26-35-31(33)28-24-21-22-25-29(28)32(34)36-30(6-2)27(3)4/h27-30H,5-26H2,1-4H3

InChI Key

DZCLNEKLTHOLGB-UHFFFAOYSA-N

Formula

C32H60O4

SMILES

CCCCCCCCCCCCCCCCCCOC(=O)C1CCCCC1C(=O)OC(CC)C(C)C

Molecular Weight¹

508.82

• 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°	-237.42	kJ/mol	Joback Calculated Property
ΔfH°gas	-1169.99	kJ/mol	Joback Calculated Property
ΔfusH°	70.07	kJ/mol	Joback Calculated Property
ΔvapH°	104.48	kJ/mol	Joback Calculated Property
log10WS	-10.22		Crippen Calculated Property
logPoct/wat	9.575		Crippen Calculated Property
McVol	465.760	ml/mol	McGowan Calculated Property
Pc	621.89	kPa	Joback Calculated Property
Inp	[3562.00; 3562.00]
Inp	3562.00		NIST
Inp	3562.00		NIST
Tboil	1098.14	K	Joback Calculated Property
Tc	1368.93	K	Joback Calculated Property
Tfus	567.86	K	Joback Calculated Property
Vc	1.796	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1734.82; 1819.54]	J/mol×K	[1098.14; 1368.93]
Cp,gas	1734.82	J/mol×K	1098.14	Joback Calculated Property
Cp,gas	1755.93	J/mol×K	1143.27	Joback Calculated Property
Cp,gas	1774.09	J/mol×K	1188.40	Joback Calculated Property
Cp,gas	1789.40	J/mol×K	1233.53	Joback Calculated Property
Cp,gas	1802.00	J/mol×K	1278.67	Joback Calculated Property
Cp,gas	1812.00	J/mol×K	1323.80	Joback Calculated Property
Cp,gas	1819.54	J/mol×K	1368.93	Joback Calculated Property
η	[0.0000095; 0.0002887]	Pa×s	[567.86; 1098.14]
η	0.0002887	Pa×s	567.86	Joback Calculated Property
η	0.0001115	Pa×s	656.24	Joback Calculated Property
η	0.0000540	Pa×s	744.62	Joback Calculated Property
η	0.0000305	Pa×s	833.00	Joback Calculated Property
η	0.0000192	Pa×s	921.38	Joback Calculated Property
η	0.0000131	Pa×s	1009.76	Joback Calculated Property
η	0.0000095	Pa×s	1098.14	Joback Calculated Property

Similar Compounds

Find more compounds similar to 1,2-Cyclohexanedicarboxylic acid, 2-methylpent-3-yl octadecyl ester.

Sources

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

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