Chemical Properties of Succinic acid, 4-chloro-3-methylphenyl 1-cyclopentylethyl ester

InChI

InChI=1S/C18H23ClO4/c1-12-11-15(7-8-16(12)19)23-18(21)10-9-17(20)22-13(2)14-5-3-4-6-14/h7-8,11,13-14H,3-6,9-10H2,1-2H3

InChI Key

YCCUDPQBDQGXKL-UHFFFAOYSA-N

Formula

C18H23ClO4

SMILES

Cc1cc(OC(=O)CCC(=O)OC(C)C2CCCC2)ccc1Cl

Molecular Weight¹

338.83

• 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	0.7834		Relay (1.0) Calculated Property
ΔfG°	-251.83	kJ/mol	Joback Calculated Property
ΔfH°gas	-816.02	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	35.82	kJ/mol	Joback Calculated Property
ΔvapH°	97.89	kJ/mol	Relay (1.0) Calculated Property
IE	8.29	eV	Relay (1.0) Calculated Property
log10WS	-5.10		Relay (1.0) Calculated Property
logPoct/wat	4.456		Crippen Calculated Property
McVol	256.980	ml/mol	McGowan Calculated Property
Pc	1733.22	kPa	Joback Calculated Property
Inp	[2585.00; 2585.00]
Inp	2585.00		NIST
Inp	2585.00		NIST
Tboil	642.99	K	Relay (1.0) Calculated Property
Tc	879.50	K	Relay (1.0) Calculated Property
Tfus	326.03	K	Relay (1.0) Calculated Property
Vc	0.925	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[778.26; 850.17]	J/mol×K	[852.73; 1077.89]
Cp,gas	778.26	J/mol×K	852.73	Joback Calculated Property
Cp,gas	793.52	J/mol×K	890.26	Joback Calculated Property
Cp,gas	807.42	J/mol×K	927.78	Joback Calculated Property
Cp,gas	820.01	J/mol×K	965.31	Joback Calculated Property
Cp,gas	831.31	J/mol×K	1002.84	Joback Calculated Property
Cp,gas	841.35	J/mol×K	1040.36	Joback Calculated Property
Cp,gas	850.17	J/mol×K	1077.89	Joback Calculated Property
η	[0.0000872; 0.0007531]	Pa×s	[514.22; 852.73]
η	0.0007531	Pa×s	514.22	Joback Calculated Property
η	0.0004402	Pa×s	570.64	Joback Calculated Property
η	0.0002834	Pa×s	627.06	Joback Calculated Property
η	0.0001962	Pa×s	683.48	Joback Calculated Property
η	0.0001437	Pa×s	739.89	Joback Calculated Property
η	0.0001100	Pa×s	796.31	Joback Calculated Property
η	0.0000872	Pa×s	852.73	Joback Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, 4-chloro-3-methylphenyl 1-cyclopentylethyl ester.

Sources

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

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