Chemical Properties of Glutaric acid, 3-methylbut-2-en-1-yl 1-naphthyl ester

InChI

InChI=1S/C20H22O4/c1-15(2)13-14-23-19(21)11-6-12-20(22)24-18-10-5-8-16-7-3-4-9-17(16)18/h3-5,7-10,13H,6,11-12,14H2,1-2H3

InChI Key

UKJAAQDOLBDUKV-UHFFFAOYSA-N

Formula

C20H22O4

SMILES

CC(C)=CCOC(=O)CCCC(=O)Oc1cccc2ccccc12

Molecular Weight¹

326.39

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• 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°	-69.22	kJ/mol	Joback Calculated Property
ΔfH°gas	-422.17	kJ/mol	Joback Calculated Property
ΔfusH°	42.69	kJ/mol	Joback Calculated Property
ΔvapH°	83.04	kJ/mol	Joback Calculated Property
log10WS	-5.65		Crippen Calculated Property
logPoct/wat	4.425		Crippen Calculated Property
McVol	260.020	ml/mol	McGowan Calculated Property
Pc	1696.30	kPa	Joback Calculated Property
Inp	[2680.00; 2680.00]
Inp	2680.00		NIST
Inp	2680.00		NIST
Tboil	864.26	K	Joback Calculated Property
Tc	1085.74	K	Joback Calculated Property
Tfus	512.08	K	Joback Calculated Property
Vc	0.999	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[775.35; 847.12]	J/mol×K	[864.26; 1085.74]
Cp,gas	775.35	J/mol×K	864.26	Joback Calculated Property
Cp,gas	789.60	J/mol×K	901.17	Joback Calculated Property
Cp,gas	802.84	J/mol×K	938.09	Joback Calculated Property
Cp,gas	815.15	J/mol×K	975.00	Joback Calculated Property
Cp,gas	826.58	J/mol×K	1011.91	Joback Calculated Property
Cp,gas	837.22	J/mol×K	1048.82	Joback Calculated Property
Cp,gas	847.12	J/mol×K	1085.74	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, 3-methylbut-2-en-1-yl 1-naphthyl ester.

Sources

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

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