Chemical Properties of Succinic acid, cyclohexylmethyl 2-isopropoxyphenyl ester

InChI

InChI=1S/C20H28O5/c1-15(2)24-17-10-6-7-11-18(17)25-20(22)13-12-19(21)23-14-16-8-4-3-5-9-16/h6-7,10-11,15-16H,3-5,8-9,12-14H2,1-2H3

InChI Key

VVCBVOFOZWGGOY-UHFFFAOYSA-N

Formula

C20H28O5

SMILES

CC(C)Oc1ccccc1OC(=O)CCC(=O)OCC1CCCCC1

Molecular Weight¹

348.43

• 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	0.8576		Relay (1.0) Calculated Property
ΔfG°	-330.53	kJ/mol	Joback Calculated Property
ΔfH°gas	-939.00	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	36.28	kJ/mol	Joback Calculated Property
ΔvapH°	100.92	kJ/mol	Relay (1.0) Calculated Property
IE	8.34	eV	Relay (1.0) Calculated Property
log10WS	-4.21		Relay (1.0) Calculated Property
logPoct/wat	4.283		Crippen Calculated Property
McVol	278.790	ml/mol	McGowan Calculated Property
Pc	1557.35	kPa	Joback Calculated Property
Inp	[2553.00; 2553.00]
Inp	2553.00		NIST
Inp	2553.00		NIST
Tboil	660.14	K	Relay (1.0) Calculated Property
Tc	874.76	K	Relay (1.0) Calculated Property
Tfus	325.39	K	Relay (1.0) Calculated Property
Vc	1.027	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[902.51; 976.38]	J/mol×K	[882.77; 1104.02]
Cp,gas	902.51	J/mol×K	882.77	Joback Calculated Property
Cp,gas	918.80	J/mol×K	919.65	Joback Calculated Property
Cp,gas	933.48	J/mol×K	956.52	Joback Calculated Property
Cp,gas	946.56	J/mol×K	993.40	Joback Calculated Property
Cp,gas	958.06	J/mol×K	1030.27	Joback Calculated Property
Cp,gas	968.00	J/mol×K	1067.15	Joback Calculated Property
Cp,gas	976.38	J/mol×K	1104.02	Joback Calculated Property
η	[0.0000388; 0.0005278]	Pa×s	[513.03; 882.77]
η	0.0005278	Pa×s	513.03	Joback Calculated Property
η	0.0002706	Pa×s	574.65	Joback Calculated Property
η	0.0001579	Pa×s	636.28	Joback Calculated Property
η	0.0001013	Pa×s	697.90	Joback Calculated Property
η	0.0000699	Pa×s	759.52	Joback Calculated Property
η	0.0000509	Pa×s	821.15	Joback Calculated Property
η	0.0000388	Pa×s	882.77	Joback Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, cyclohexylmethyl 2-isopropoxyphenyl ester.

Sources

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

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