Chemical Properties of Succinic acid, 4-chloro-3-methylphenyl cis-4-methylcyclohexyl ester

InChI

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

InChI Key

YJONPWCLHGBIOL-UHFFFAOYSA-N

Formula

C18H23ClO4

SMILES

Cc1cc(OC(=O)CCC(=O)OC2CCC(C)CC2)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	0.7747		Relay (1.0) Calculated Property
ΔfG°	-269.20	kJ/mol	Joback Calculated Property
ΔfH°gas	-811.88	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	38.32	kJ/mol	Joback Calculated Property
ΔvapH°	99.56	kJ/mol	Relay (1.0) Calculated Property
IE	8.37	eV	Relay (1.0) Calculated Property
log10WS	-5.22		Relay (1.0) Calculated Property
logPoct/wat	4.456		Crippen Calculated Property
McVol	256.980	ml/mol	McGowan Calculated Property
Pc	1710.36	kPa	Joback Calculated Property
Inp	[2540.00; 2540.00]
Inp	2540.00		NIST
Inp	2540.00		NIST
Tboil	647.98	K	Relay (1.0) Calculated Property
Tc	881.93	K	Relay (1.0) Calculated Property
Tfus	329.70	K	Relay (1.0) Calculated Property
Vc	0.931	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[785.60; 857.65]	J/mol×K	[852.77; 1079.80]
Cp,gas	785.60	J/mol×K	852.77	Joback Calculated Property
Cp,gas	801.34	J/mol×K	890.61	Joback Calculated Property
Cp,gas	815.58	J/mol×K	928.45	Joback Calculated Property
Cp,gas	828.31	J/mol×K	966.29	Joback Calculated Property
Cp,gas	839.56	J/mol×K	1004.13	Joback Calculated Property
Cp,gas	849.33	J/mol×K	1041.96	Joback Calculated Property
Cp,gas	857.65	J/mol×K	1079.80	Joback Calculated Property
η	[0.0000854; 0.0006484]	Pa×s	[521.46; 852.77]
η	0.0006484	Pa×s	521.46	Joback Calculated Property
η	0.0003934	Pa×s	576.68	Joback Calculated Property
η	0.0002605	Pa×s	631.90	Joback Calculated Property
η	0.0001843	Pa×s	687.12	Joback Calculated Property
η	0.0001373	Pa×s	742.33	Joback Calculated Property
η	0.0001065	Pa×s	797.55	Joback Calculated Property
η	0.0000854	Pa×s	852.77	Joback Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, 4-chloro-3-methylphenyl cis-4-methylcyclohexyl ester.

Sources

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

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