Chemical Properties of Glutaric acid, naphth-2-ylmethyl 3,7-dimethyloctyl ester

InChI

InChI=1S/C26H36O4/c1-20(2)8-6-9-21(3)16-17-29-25(27)12-7-13-26(28)30-19-22-14-15-23-10-4-5-11-24(23)18-22/h4-5,10-11,14-15,18,20-21H,6-9,12-13,16-17,19H2,1-3H3

InChI Key

YJFXOVQJRARHTG-UHFFFAOYSA-N

Formula

C26H36O4

SMILES

CC(C)CCCC(C)CCOC(=O)CCCC(=O)OCc1ccc2ccccc2c1

Molecular Weight¹

412.56

• 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	1.0443		Relay (1.0) Calculated Property
ΔfG°	-95.25	kJ/mol	Joback Calculated Property
ΔfH°gas	-804.58	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	52.29	kJ/mol	Joback Calculated Property
ΔvapH°	124.82	kJ/mol	Relay (1.0) Calculated Property
IE	8.00	eV	Relay (1.0) Calculated Property
log10WS	-6.49		Relay (1.0) Calculated Property
logPoct/wat	6.449		Crippen Calculated Property
McVol	348.860	ml/mol	McGowan Calculated Property
Pc	1078.51	kPa	Joback Calculated Property
Inp	[3215.00; 3215.00]
Inp	3215.00		NIST
Inp	3215.00		NIST
Tboil	724.96	K	Relay (1.0) Calculated Property
Tc	939.77	K	Relay (1.0) Calculated Property
Tfus	324.67	K	Relay (1.0) Calculated Property
Vc	1.272	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1162.97; 1240.33]	J/mol×K	[996.62; 1221.26]
Cp,gas	1162.97	J/mol×K	996.62	Joback Calculated Property
Cp,gas	1178.82	J/mol×K	1034.06	Joback Calculated Property
Cp,gas	1193.38	J/mol×K	1071.50	Joback Calculated Property
Cp,gas	1206.73	J/mol×K	1108.94	Joback Calculated Property
Cp,gas	1218.95	J/mol×K	1146.38	Joback Calculated Property
Cp,gas	1230.13	J/mol×K	1183.82	Joback Calculated Property
Cp,gas	1240.33	J/mol×K	1221.26	Joback Calculated Property
η	[0.0000396; 0.0004621]	Pa×s	[568.74; 996.62]
η	0.0004621	Pa×s	568.74	Joback Calculated Property
η	0.0002442	Pa×s	640.05	Joback Calculated Property
η	0.0001467	Pa×s	711.37	Joback Calculated Property
η	0.0000967	Pa×s	782.68	Joback Calculated Property
η	0.0000683	Pa×s	853.99	Joback Calculated Property
η	0.0000509	Pa×s	925.31	Joback Calculated Property
η	0.0000396	Pa×s	996.62	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, naphth-2-ylmethyl 3,7-dimethyloctyl ester.

Sources

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

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