Chemical Properties of Phthalic acid, 2,2-dimethylpent-3-yl nonyl ester

InChI

InChI=1S/C24H38O4/c1-6-8-9-10-11-12-15-18-27-22(25)19-16-13-14-17-20(19)23(26)28-21(7-2)24(3,4)5/h13-14,16-17,21H,6-12,15,18H2,1-5H3

InChI Key

OSEJPVJYQHMJID-UHFFFAOYSA-N

Formula

C24H38O4

SMILES

CCCCCCCCCOC(=O)c1ccccc1C(=O)OC(CC)C(C)(C)C

Molecular Weight¹

390.56

• 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	1.0362		Relay (1.0) Calculated Property
ΔfG°	-213.46	kJ/mol	Joback Calculated Property
ΔfH°gas	-922.95	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	46.20	kJ/mol	Joback Calculated Property
ΔvapH°	101.50	kJ/mol	Relay (1.0) Calculated Property
IE	9.13	eV	Relay (1.0) Calculated Property
log10WS	-6.86		Relay (1.0) Calculated Property
logPoct/wat	6.575		Crippen Calculated Property
McVol	340.140	ml/mol	McGowan Calculated Property
Pc	1049.37	kPa	Joback Calculated Property
Inp	[2795.00; 2795.00]
Inp	2795.00		NIST
Inp	2795.00		NIST
Tboil	654.64	K	Relay (1.0) Calculated Property
Tc	861.52	K	Relay (1.0) Calculated Property
Tfus	288.84	K	Relay (1.0) Calculated Property
Vc	1.254	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1120.03; 1203.78]	J/mol×K	[929.09; 1140.66]
Cp,gas	1120.03	J/mol×K	929.09	Joback Calculated Property
Cp,gas	1137.08	J/mol×K	964.35	Joback Calculated Property
Cp,gas	1152.82	J/mol×K	999.61	Joback Calculated Property
Cp,gas	1167.30	J/mol×K	1034.87	Joback Calculated Property
Cp,gas	1180.59	J/mol×K	1070.14	Joback Calculated Property
Cp,gas	1192.72	J/mol×K	1105.40	Joback Calculated Property
Cp,gas	1203.78	J/mol×K	1140.66	Joback Calculated Property
η	[0.0000216; 0.0003846]	Pa×s	[530.92; 929.09]
η	0.0003846	Pa×s	530.92	Joback Calculated Property
η	0.0001823	Pa×s	597.28	Joback Calculated Property
η	0.0001003	Pa×s	663.64	Joback Calculated Property
η	0.0000616	Pa×s	730.00	Joback Calculated Property
η	0.0000410	Pa×s	796.37	Joback Calculated Property
η	0.0000290	Pa×s	862.73	Joback Calculated Property
η	0.0000216	Pa×s	929.09	Joback Calculated Property

Similar Compounds

Find more compounds similar to Phthalic acid, 2,2-dimethylpent-3-yl nonyl ester.

Sources

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

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