Chemical Properties of Succinic acid, 3-methylbut-2-yl 3,3-dimethylbut-2-yl ester

InChI

InChI=1S/C15H28O4/c1-10(2)11(3)18-13(16)8-9-14(17)19-12(4)15(5,6)7/h10-12H,8-9H2,1-7H3

InChI Key

YPXNSXAFIXVBIY-UHFFFAOYSA-N

Formula

C15H28O4

SMILES

CC(C)C(C)OC(=O)CCC(=O)OC(C)C(C)(C)C

Molecular Weight¹

272.38

• ω : Acentric Factor.
• 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).
• 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	0.6828		Relay (1.0) Calculated Property
ΔfG°	-396.90	kJ/mol	Joback Calculated Property
ΔfH°gas	-1020.36	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	22.20	kJ/mol	Joback Calculated Property
ΔvapH°	73.06	kJ/mol	Relay (1.0) Calculated Property
IE	9.61	eV	Relay (1.0) Calculated Property
log10WS	-3.51		Relay (1.0) Calculated Property
logPoct/wat	3.332		Crippen Calculated Property
McVol	237.090	ml/mol	McGowan Calculated Property
Pc	1570.96	kPa	Joback Calculated Property
Inp	[1606.00; 1606.00]
Inp	1606.00		NIST
Inp	1606.00		NIST
Tboil	534.36	K	Relay (1.0) Calculated Property
Tc	711.44	K	Relay (1.0) Calculated Property
Tfus	289.96	K	Relay (1.0) Calculated Property
Vc	0.877	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[681.05; 770.84]	J/mol×K	[690.63; 880.65]
Cp,gas	681.05	J/mol×K	690.63	Joback Calculated Property
Cp,gas	698.33	J/mol×K	722.30	Joback Calculated Property
Cp,gas	714.65	J/mol×K	753.97	Joback Calculated Property
Cp,gas	730.05	J/mol×K	785.64	Joback Calculated Property
Cp,gas	744.53	J/mol×K	817.31	Joback Calculated Property
Cp,gas	758.12	J/mol×K	848.98	Joback Calculated Property
Cp,gas	770.84	J/mol×K	880.65	Joback Calculated Property
η	[0.0000708; 0.0029478]	Pa×s	[360.55; 690.63]
η	0.0029478	Pa×s	360.55	Joback Calculated Property
η	0.0010492	Pa×s	415.56	Joback Calculated Property
η	0.0004755	Pa×s	470.58	Joback Calculated Property
η	0.0002543	Pa×s	525.59	Joback Calculated Property
η	0.0001531	Pa×s	580.60	Joback Calculated Property
η	0.0001007	Pa×s	635.62	Joback Calculated Property
η	0.0000708	Pa×s	690.63	Joback Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, 3-methylbut-2-yl 3,3-dimethylbut-2-yl ester.

Sources

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

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