Chemical Properties of Succinic acid, dodecyl 3-methylbut-3-enyl ester

InChI

InChI=1S/C21H38O4/c1-4-5-6-7-8-9-10-11-12-13-17-24-20(22)14-15-21(23)25-18-16-19(2)3/h2,4-18H2,1,3H3

InChI Key

JBYGSDAHPGMHMJ-UHFFFAOYSA-N

Formula

C21H38O4

SMILES

C=C(C)CCOC(=O)CCC(=O)OCCCCCCCCCCCC

Molecular Weight¹

354.52

• 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°	-262.61	kJ/mol	Joback Calculated Property
ΔfH°gas	-850.73	kJ/mol	Joback Calculated Property
ΔfusH°	53.13	kJ/mol	Joback Calculated Property
ΔvapH°	80.06	kJ/mol	Joback Calculated Property
log10WS	-6.19		Crippen Calculated Property
logPoct/wat	5.740		Crippen Calculated Property
McVol	317.330	ml/mol	McGowan Calculated Property
Pc	1043.95	kPa	Joback Calculated Property
Inp	[2416.00; 2416.00]
Inp	2416.00		NIST
Inp	2416.00		NIST
Tboil	829.02	K	Joback Calculated Property
Tc	1016.77	K	Joback Calculated Property
Tfus	455.03	K	Joback Calculated Property
Vc	1.242	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1002.41; 1095.87]	J/mol×K	[829.02; 1016.77]
Cp,gas	1002.41	J/mol×K	829.02	Joback Calculated Property
Cp,gas	1020.59	J/mol×K	860.31	Joback Calculated Property
Cp,gas	1037.70	J/mol×K	891.60	Joback Calculated Property
Cp,gas	1053.75	J/mol×K	922.89	Joback Calculated Property
Cp,gas	1068.79	J/mol×K	954.19	Joback Calculated Property
Cp,gas	1082.82	J/mol×K	985.48	Joback Calculated Property
Cp,gas	1095.87	J/mol×K	1016.77	Joback Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, dodecyl 3-methylbut-3-enyl ester.

Sources

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

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