Chemical Properties of Succinic acid, cyclohexylmethyl 4-chloro-2-methoxyphenyl ester

InChI

InChI=1S/C18H23ClO5/c1-22-16-11-14(19)7-8-15(16)24-18(21)10-9-17(20)23-12-13-5-3-2-4-6-13/h7-8,11,13H,2-6,9-10,12H2,1H3

InChI Key

YIHMJNJJADKHRM-UHFFFAOYSA-N

Formula

C18H23ClO5

SMILES

COc1cc(Cl)ccc1OC(=O)CCC(=O)OCC1CCCCC1

Molecular Weight¹

354.82

• 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	0.8471		Relay (1.0) Calculated Property
ΔfG°	-366.49	kJ/mol	Joback Calculated Property
ΔfH°gas	-906.12	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	38.43	kJ/mol	Joback Calculated Property
ΔvapH°	104.48	kJ/mol	Relay (1.0) Calculated Property
IE	8.25	eV	Relay (1.0) Calculated Property
log10WS	-4.83		Relay (1.0) Calculated Property
logPoct/wat	4.158		Crippen Calculated Property
McVol	262.850	ml/mol	McGowan Calculated Property
Pc	1733.22	kPa	Joback Calculated Property
Inp	[2680.00; 2680.00]
Inp	2680.00		NIST
Inp	2680.00		NIST
Tboil	672.92	K	Relay (1.0) Calculated Property
Tc	892.95	K	Relay (1.0) Calculated Property
Tfus	330.76	K	Relay (1.0) Calculated Property
Vc	0.947	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[809.20; 873.48]	J/mol×K	[879.86; 1105.70]
Cp,gas	809.20	J/mol×K	879.86	Joback Calculated Property
Cp,gas	823.74	J/mol×K	917.50	Joback Calculated Property
Cp,gas	836.75	J/mol×K	955.14	Joback Calculated Property
Cp,gas	848.22	J/mol×K	992.78	Joback Calculated Property
Cp,gas	858.16	J/mol×K	1030.42	Joback Calculated Property
Cp,gas	866.58	J/mol×K	1068.06	Joback Calculated Property
Cp,gas	873.48	J/mol×K	1105.70	Joback Calculated Property
η	[0.0000494; 0.0004150]	Pa×s	[547.93; 879.86]
η	0.0004150	Pa×s	547.93	Joback Calculated Property
η	0.0002474	Pa×s	603.25	Joback Calculated Property
η	0.0001609	Pa×s	658.57	Joback Calculated Property
η	0.0001119	Pa×s	713.89	Joback Calculated Property
η	0.0000819	Pa×s	769.22	Joback Calculated Property
η	0.0000626	Pa×s	824.54	Joback Calculated Property
η	0.0000494	Pa×s	879.86	Joback Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, cyclohexylmethyl 4-chloro-2-methoxyphenyl ester.

Sources

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

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