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

InChI

InChI=1S/C16H20O5/c1-12(2)9-10-20-15(17)7-8-16(18)21-14-6-4-5-13(11-14)19-3/h4-6,9,11H,7-8,10H2,1-3H3

InChI Key

GWVVYEBKTHTTMW-UHFFFAOYSA-N

Formula

C16H20O5

SMILES

COc1cccc(OC(=O)CCC(=O)OCC=C(C)C)c1

Molecular Weight¹

292.33

• ω : Acentric Factor.
• 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).
• 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	0.7894		Relay (... Calculated Property
ΔfG°	-314.55	kJ/mol	Joback Calculated Property
ΔfH°gas	-776.82	kJ/mol	Relay (... Calculated Property
ΔfusH°	36.50	kJ/mol	Joback Calculated Property
ΔvapH°	92.93	kJ/mol	Relay (... Calculated Property
IE	8.13	eV	Relay (... Calculated Property
log10WS	-4.04		Relay (... Calculated Property
logPoct/wat	2.890		Crippen Calculated Property
McVol	228.990	ml/mol	McGowan Calculated Property
Pc	1880.53	kPa	Joback Calculated Property
Inp	[2234.00; 2234.00]
Inp	2234.00		NIST
Inp	2234.00		NIST
Tboil	620.96	K	Relay (... Calculated Property
Tc	812.57	K	Relay (... Calculated Property
Tfus	312.93	K	Relay (... Calculated Property
Vc	0.831	m3/kmol	Relay (... Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[650.85; 722.27]	J/mol×K	[776.18; 985.59]
Cp,gas	650.85	J/mol×K	776.18	Joback Calculated Property
Cp,gas	665.23	J/mol×K	811.08	Joback Calculated Property
Cp,gas	678.61	J/mol×K	845.98	Joback Calculated Property
Cp,gas	690.98	J/mol×K	880.88	Joback Calculated Property
Cp,gas	702.38	J/mol×K	915.78	Joback Calculated Property
Cp,gas	712.81	J/mol×K	950.69	Joback Calculated Property
Cp,gas	722.27	J/mol×K	985.59	Joback Calculated Property

Similar Compounds

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

Sources

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

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