Chemical Properties of 1,2-Cyclohexanedicarboxylic acid, 5-methoxy-3-methylpentyl pentadecyl ester

InChI

InChI=1S/C30H56O5/c1-4-5-6-7-8-9-10-11-12-13-14-15-18-23-34-29(31)27-19-16-17-20-28(27)30(32)35-25-22-26(2)21-24-33-3/h26-28H,4-25H2,1-3H3

InChI Key

RHGLNHKVMWYFDL-UHFFFAOYSA-N

Formula

C30H56O5

SMILES

CCCCCCCCCCCCCCCOC(=O)C1CCCCC1C(=O)OCCC(C)CCOC

Molecular Weight¹

496.76

• 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°	-356.82	kJ/mol	Joback Calculated Property
ΔfH°gas	-1255.65	kJ/mol	Joback Calculated Property
ΔfusH°	69.60	kJ/mol	Joback Calculated Property
ΔvapH°	102.83	kJ/mol	Joback Calculated Property
log10WS	-8.36		Crippen Calculated Property
logPoct/wat	8.033		Crippen Calculated Property
McVol	443.450	ml/mol	McGowan Calculated Property
Pc	677.11	kPa	Joback Calculated Property
Inp	[3393.00; 3393.00]
Inp	3393.00		NIST
Inp	3393.00		NIST
Tboil	1075.24	K	Joback Calculated Property
Tc	1335.18	K	Joback Calculated Property
Tfus	582.55	K	Joback Calculated Property
Vc	1.708	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1634.05; 1708.81]	J/mol×K	[1075.24; 1335.18]
Cp,gas	1634.05	J/mol×K	1075.24	Joback Calculated Property
Cp,gas	1653.62	J/mol×K	1118.56	Joback Calculated Property
Cp,gas	1670.25	J/mol×K	1161.89	Joback Calculated Property
Cp,gas	1684.01	J/mol×K	1205.21	Joback Calculated Property
Cp,gas	1694.98	J/mol×K	1248.53	Joback Calculated Property
Cp,gas	1703.22	J/mol×K	1291.86	Joback Calculated Property
Cp,gas	1708.81	J/mol×K	1335.18	Joback Calculated Property
η	[0.0000106; 0.0002283]	Pa×s	[582.55; 1075.24]
η	0.0002283	Pa×s	582.55	Joback Calculated Property
η	0.0000997	Pa×s	664.66	Joback Calculated Property
η	0.0000522	Pa×s	746.78	Joback Calculated Property
η	0.0000311	Pa×s	828.89	Joback Calculated Property
η	0.0000203	Pa×s	911.01	Joback Calculated Property
η	0.0000143	Pa×s	993.12	Joback Calculated Property
η	0.0000106	Pa×s	1075.24	Joback Calculated Property

Similar Compounds

Find more compounds similar to 1,2-Cyclohexanedicarboxylic acid, 5-methoxy-3-methylpentyl pentadecyl ester.

Sources

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

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