Chemical Properties of (1-Methylhexyl)succinic acid, methyl ester

InChI

InChI=1S/C13H24O4/c1-5-6-7-8-10(2)11(13(15)17-4)9-12(14)16-3/h10-11H,5-9H2,1-4H3

InChI Key

FBEAETQIDNMZBP-UHFFFAOYSA-N

Formula

C13H24O4

SMILES

CCCCCC(C)C(CC(=O)OC)C(=O)OC

Molecular Weight¹

244.33

• 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).
• 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°	-414.14	kJ/mol	Joback Calculated Property
ΔfH°gas	-811.81	kJ/mol	Joback Calculated Property
ΔfusH°	27.95	kJ/mol	Joback Calculated Property
ΔvapH°	62.07	kJ/mol	Joback Calculated Property
log10WS	-2.51		Crippen Calculated Property
logPoct/wat	2.555		Crippen Calculated Property
McVol	208.910	ml/mol	McGowan Calculated Property
Pc	1798.51	kPa	Joback Calculated Property
Inp	[1569.00; 1571.00]
Inp	1569.00		NIST
Inp	1571.00		NIST
Tboil	648.54	K	Joback Calculated Property
Tc	830.39	K	Joback Calculated Property
Tfus	350.59	K	Joback Calculated Property
Vc	0.799	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[569.26; 652.22]	J/mol×K	[648.54; 830.39]
Cp,gas	569.26	J/mol×K	648.54	Joback Calculated Property
Cp,gas	584.92	J/mol×K	678.85	Joback Calculated Property
Cp,gas	599.84	J/mol×K	709.16	Joback Calculated Property
Cp,gas	614.03	J/mol×K	739.46	Joback Calculated Property
Cp,gas	627.48	J/mol×K	769.77	Joback Calculated Property
Cp,gas	640.21	J/mol×K	800.08	Joback Calculated Property
Cp,gas	652.22	J/mol×K	830.39	Joback Calculated Property
η	[0.0001169; 0.0025317]	Pa×s	[350.59; 648.54]
η	0.0025317	Pa×s	350.59	Joback Calculated Property
η	0.0011034	Pa×s	400.25	Joback Calculated Property
η	0.0005777	Pa×s	449.91	Joback Calculated Property
η	0.0003440	Pa×s	499.56	Joback Calculated Property
η	0.0002249	Pa×s	549.22	Joback Calculated Property
η	0.0001578	Pa×s	598.88	Joback Calculated Property
η	0.0001169	Pa×s	648.54	Joback Calculated Property

Similar Compounds

Find more compounds similar to (1-Methylhexyl)succinic acid, methyl ester.

Sources

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

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