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

InChI

InChI=1S/C31H50O4/c1-4-5-6-7-8-9-10-11-12-13-14-15-18-21-34-30(32)28-19-16-17-20-29(28)31(33)35-27-23-25(2)22-26(3)24-27/h22-24,28-29H,4-21H2,1-3H3

InChI Key

ARWFZOWRCXHPFK-UHFFFAOYSA-N

Formula

C31H50O4

SMILES

CCCCCCCCCCCCCCCOC(=O)C1CCCCC1C(=O)Oc1cc(C)cc(C)c1

Molecular Weight¹

486.73

• 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°	-147.81	kJ/mol	Joback Calculated Property
ΔfH°gas	-925.20	kJ/mol	Joback Calculated Property
ΔfusH°	67.79	kJ/mol	Joback Calculated Property
ΔvapH°	106.63	kJ/mol	Joback Calculated Property
log10WS	-9.80		Crippen Calculated Property
logPoct/wat	8.650		Crippen Calculated Property
McVol	427.910	ml/mol	McGowan Calculated Property
Pc	759.32	kPa	Joback Calculated Property
Inp	[3551.00; 3551.00]
Inp	3551.00		NIST
Inp	3551.00		NIST
Tboil	1112.78	K	Joback Calculated Property
Tc	1369.64	K	Joback Calculated Property
Tfus	638.05	K	Joback Calculated Property
Vc	1.643	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1556.06; 1617.85]	J/mol×K	[1112.78; 1369.64]
Cp,gas	1556.06	J/mol×K	1112.78	Joback Calculated Property
Cp,gas	1572.27	J/mol×K	1155.59	Joback Calculated Property
Cp,gas	1586.00	J/mol×K	1198.40	Joback Calculated Property
Cp,gas	1597.33	J/mol×K	1241.21	Joback Calculated Property
Cp,gas	1606.36	J/mol×K	1284.02	Joback Calculated Property
Cp,gas	1613.17	J/mol×K	1326.83	Joback Calculated Property
Cp,gas	1617.85	J/mol×K	1369.64	Joback Calculated Property
η	[0.0000151; 0.0001887]	Pa×s	[638.05; 1112.78]
η	0.0001887	Pa×s	638.05	Joback Calculated Property
η	0.0000983	Pa×s	717.17	Joback Calculated Property
η	0.0000583	Pa×s	796.29	Joback Calculated Property
η	0.0000380	Pa×s	875.41	Joback Calculated Property
η	0.0000266	Pa×s	954.54	Joback Calculated Property
η	0.0000196	Pa×s	1033.66	Joback Calculated Property
η	0.0000151	Pa×s	1112.78	Joback Calculated Property

Similar Compounds

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

Sources

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

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