Chemical Properties of 1,2-Cyclohexanedicarboxylic acid, heptyl pentadecyl ester

InChI

InChI=1S/C30H56O4/c1-3-5-7-9-10-11-12-13-14-15-16-18-22-26-34-30(32)28-24-20-19-23-27(28)29(31)33-25-21-17-8-6-4-2/h27-28H,3-26H2,1-2H3

InChI Key

GPSCEVFREBAQSZ-UHFFFAOYSA-N

Formula

C30H56O4

SMILES

CCCCCCCCCCCCCCCOC(=O)C1CCCCC1C(=O)OCCCCCCC

Molecular Weight¹

480.76

• ω : Acentric Factor.
• 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).
• IE : Ionization energy (eV).
• 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
ω	1.2389		Relay (... Calculated Property
ΔfG°	-249.38	kJ/mol	Joback Calculated Property
ΔfH°gas	-1209.11	kJ/mol	Relay (... Calculated Property
ΔfusH°	71.94	kJ/mol	Joback Calculated Property
ΔvapH°	135.29	kJ/mol	Relay (... Calculated Property
IE	9.86	eV	Relay (... Calculated Property
log10WS	-8.42		Relay (... Calculated Property
logPoct/wat	8.941		Crippen Calculated Property
McVol	437.580	ml/mol	McGowan Calculated Property
Pc	680.29	kPa	Joback Calculated Property
Inp	[3345.00; 3345.00]
Inp	3345.00		NIST
Inp	3345.00		NIST
Tboil	685.41	K	Relay (... Calculated Property
Tc	898.37	K	Relay (... Calculated Property
Tfus	321.02	K	Relay (... Calculated Property
Vc	1.645	m3/kmol	Relay (... Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1604.51; 1695.39]	J/mol×K	[1053.26; 1304.73]
Cp,gas	1604.51	J/mol×K	1053.26	Joback Calculated Property
Cp,gas	1625.68	J/mol×K	1095.17	Joback Calculated Property
Cp,gas	1644.32	J/mol×K	1137.08	Joback Calculated Property
Cp,gas	1660.52	J/mol×K	1179.00	Joback Calculated Property
Cp,gas	1674.38	J/mol×K	1220.91	Joback Calculated Property
Cp,gas	1685.97	J/mol×K	1262.82	Joback Calculated Property
Cp,gas	1695.39	J/mol×K	1304.73	Joback Calculated Property
η	[0.0000159; 0.0003062]	Pa×s	[575.32; 1053.26]
η	0.0003062	Pa×s	575.32	Joback Calculated Property
η	0.0001386	Pa×s	654.98	Joback Calculated Property
η	0.0000745	Pa×s	734.63	Joback Calculated Property
η	0.0000452	Pa×s	814.29	Joback Calculated Property
η	0.0000300	Pa×s	893.95	Joback Calculated Property
η	0.0000213	Pa×s	973.60	Joback Calculated Property
η	0.0000159	Pa×s	1053.26	Joback Calculated Property

Similar Compounds

Find more compounds similar to 1,2-Cyclohexanedicarboxylic acid, heptyl pentadecyl ester.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.