Chemical Properties of Succinic acid, 3-methylbut-2-yl trans-4-tert-butylcyclohexyl ester

InChI

InChI=1S/C19H34O4/c1-13(2)14(3)22-17(20)11-12-18(21)23-16-9-7-15(8-10-16)19(4,5)6/h13-16H,7-12H2,1-6H3

InChI Key

YRCWXOLGCPYLKU-UHFFFAOYSA-N

Formula

C19H34O4

SMILES

CC(C)C(C)OC(=O)CCC(=O)OC1CCC(C(C)(C)C)CC1

Molecular Weight¹

326.47

• 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	0.7057		Relay (... Calculated Property
ΔfG°	-344.04	kJ/mol	Joback Calculated Property
ΔfH°gas	-1010.78	kJ/mol	Relay (... Calculated Property
ΔfusH°	28.99	kJ/mol	Joback Calculated Property
ΔvapH°	87.97	kJ/mol	Relay (... Calculated Property
IE	9.26	eV	Relay (... Calculated Property
log10WS	-4.47		Relay (... Calculated Property
logPoct/wat	4.502		Crippen Calculated Property
McVol	282.590	ml/mol	McGowan Calculated Property
Pc	1329.07	kPa	Joback Calculated Property
Inp	[2193.00; 2193.00]
Inp	2193.00		NIST
Inp	2193.00		NIST
Tboil	602.34	K	Relay (... Calculated Property
Tc	799.87	K	Relay (... Calculated Property
Tfus	321.67	K	Relay (... Calculated Property
Vc	1.014	m3/kmol	Relay (... Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[910.83; 1009.87]	J/mol×K	[797.47; 1002.71]
Cp,gas	910.83	J/mol×K	797.47	Joback Calculated Property
Cp,gas	930.77	J/mol×K	831.68	Joback Calculated Property
Cp,gas	949.29	J/mol×K	865.88	Joback Calculated Property
Cp,gas	966.43	J/mol×K	900.09	Joback Calculated Property
Cp,gas	982.22	J/mol×K	934.30	Joback Calculated Property
Cp,gas	996.69	J/mol×K	968.50	Joback Calculated Property
Cp,gas	1009.87	J/mol×K	1002.71	Joback Calculated Property
η	[0.0000550; 0.0015658]	Pa×s	[423.77; 797.47]
η	0.0015658	Pa×s	423.77	Joback Calculated Property
η	0.0006266	Pa×s	486.05	Joback Calculated Property
η	0.0003087	Pa×s	548.34	Joback Calculated Property
η	0.0001758	Pa×s	610.62	Joback Calculated Property
η	0.0001110	Pa×s	672.90	Joback Calculated Property
η	0.0000758	Pa×s	735.19	Joback Calculated Property
η	0.0000550	Pa×s	797.47	Joback Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, 3-methylbut-2-yl trans-4-tert-butylcyclohexyl ester.

Sources

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

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