Chemical Properties of Succinic acid, octyl 1-tert-butoxyprop-2-yl ester

InChI

InChI=1S/C19H36O5/c1-6-8-9-10-11-12-15-22-16(20)13-14-17(21)23-18(7-2)24-19(3,4)5/h18H,6-15H2,1-5H3

InChI Key

BEAKKBOKBOEJHD-UHFFFAOYSA-N

Formula

C19H36O5

SMILES

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

Molecular Weight¹

344.49

• 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	0.9218		Relay (... Calculated Property
ΔfG°	-463.34	kJ/mol	Joback Calculated Property
ΔfH°gas	-1232.23	kJ/mol	Relay (... Calculated Property
ΔfusH°	40.79	kJ/mol	Joback Calculated Property
ΔvapH°	87.89	kJ/mol	Relay (... Calculated Property
IE	9.32	eV	Relay (... Calculated Property
log10WS	-4.04		Relay (... Calculated Property
logPoct/wat	4.765		Crippen Calculated Property
McVol	299.320	ml/mol	McGowan Calculated Property
Pc	1156.93	kPa	Joback Calculated Property
Inp	[2140.00; 2140.00]
Inp	2140.00		NIST
Inp	2140.00		NIST
Tboil	588.07	K	Relay (... Calculated Property
Tc	750.95	K	Relay (... Calculated Property
Tfus	253.57	K	Relay (... Calculated Property
Vc	1.148	m3/kmol	Relay (... Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[941.83; 1032.30]	J/mol×K	[805.45; 992.66]
Cp,gas	941.83	J/mol×K	805.45	Joback Calculated Property
Cp,gas	959.54	J/mol×K	836.65	Joback Calculated Property
Cp,gas	976.17	J/mol×K	867.85	Joback Calculated Property
Cp,gas	991.75	J/mol×K	899.06	Joback Calculated Property
Cp,gas	1006.28	J/mol×K	930.26	Joback Calculated Property
Cp,gas	1019.79	J/mol×K	961.46	Joback Calculated Property
Cp,gas	1032.30	J/mol×K	992.66	Joback Calculated Property
η	[0.0000339; 0.0007172]	Pa×s	[457.86; 805.45]
η	0.0007172	Pa×s	457.86	Joback Calculated Property
η	0.0003242	Pa×s	515.79	Joback Calculated Property
η	0.0001720	Pa×s	573.72	Joback Calculated Property
η	0.0001026	Pa×s	631.65	Joback Calculated Property
η	0.0000667	Pa×s	689.59	Joback Calculated Property
η	0.0000464	Pa×s	747.52	Joback Calculated Property
η	0.0000339	Pa×s	805.45	Joback Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, octyl 1-tert-butoxyprop-2-yl ester.

Sources

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

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