Chemical Properties of Succinic acid, 3-methylbut-2-en-1-yl 2-isopropoxyphenyl ester

InChI

InChI=1S/C18H24O5/c1-13(2)11-12-21-17(19)9-10-18(20)23-16-8-6-5-7-15(16)22-14(3)4/h5-8,11,14H,9-10,12H2,1-4H3

InChI Key

PQBMVRLCQWQQAB-UHFFFAOYSA-N

Formula

C18H24O5

SMILES

CC(C)=CCOC(=O)CCC(=O)Oc1ccccc1OC(C)C

Molecular Weight¹

320.38

• 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°	-300.15	kJ/mol	Joback Calculated Property
ΔfH°gas	-709.46	kJ/mol	Joback Calculated Property
ΔfusH°	38.16	kJ/mol	Joback Calculated Property
ΔvapH°	78.97	kJ/mol	Joback Calculated Property
log10WS	-4.50		Crippen Calculated Property
logPoct/wat	3.669		Crippen Calculated Property
McVol	257.170	ml/mol	McGowan Calculated Property
Pc	1612.88	kPa	Joback Calculated Property
Inp	[2239.00; 2239.00]
Inp	2239.00		NIST
Inp	2239.00		NIST
Tboil	821.50	K	Joback Calculated Property
Tc	1030.69	K	Joback Calculated Property
Tfus	464.07	K	Joback Calculated Property
Vc	0.977	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[764.11; 838.07]	J/mol×K	[821.50; 1030.69]
Cp,gas	764.11	J/mol×K	821.50	Joback Calculated Property
Cp,gas	779.17	J/mol×K	856.37	Joback Calculated Property
Cp,gas	793.11	J/mol×K	891.23	Joback Calculated Property
Cp,gas	805.95	J/mol×K	926.10	Joback Calculated Property
Cp,gas	817.71	J/mol×K	960.96	Joback Calculated Property
Cp,gas	828.41	J/mol×K	995.83	Joback Calculated Property
Cp,gas	838.07	J/mol×K	1030.69	Joback Calculated Property

Similar Compounds

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

Sources

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

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