Chemical Properties of Succinic acid, 3-chlorophenyl (2-chlorocyclohexyl)methyl ester

InChI

InChI=1S/C17H20Cl2O4/c18-13-5-3-6-14(10-13)23-17(21)9-8-16(20)22-11-12-4-1-2-7-15(12)19/h3,5-6,10,12,15H,1-2,4,7-9,11H2

InChI Key

GMIRTKNNDZWBBM-UHFFFAOYSA-N

Formula

C17H20Cl2O4

SMILES

O=C(CCC(=O)Oc1cccc(Cl)c1)OCC1CCCCC1Cl

Molecular Weight¹

359.24

• 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).
• 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
ΔfG°	-279.92	kJ/mol	Joback Calculated Property
ΔfH°gas	-656.25	kJ/mol	Joback Calculated Property
ΔfusH°	40.31	kJ/mol	Joback Calculated Property
ΔvapH°	83.58	kJ/mol	Joback Calculated Property
log10WS	-5.02		Crippen Calculated Property
logPoct/wat	4.366		Crippen Calculated Property
McVol	255.130	ml/mol	McGowan Calculated Property
Pc	1820.06	kPa	Joback Calculated Property
Inp	[2742.00; 2742.00]
Inp	2742.00		NIST
Inp	2742.00		NIST
Tboil	862.34	K	Joback Calculated Property
Tc	1094.19	K	Joback Calculated Property
Tfus	527.59	K	Joback Calculated Property
Vc	0.958	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[753.98; 817.74]	J/mol×K	[862.34; 1094.19]
Cp,gas	753.98	J/mol×K	862.34	Joback Calculated Property
Cp,gas	768.27	J/mol×K	900.98	Joback Calculated Property
Cp,gas	781.07	J/mol×K	939.62	Joback Calculated Property
Cp,gas	792.39	J/mol×K	978.26	Joback Calculated Property
Cp,gas	802.26	J/mol×K	1016.91	Joback Calculated Property
Cp,gas	810.71	J/mol×K	1055.55	Joback Calculated Property
Cp,gas	817.74	J/mol×K	1094.19	Joback Calculated Property
η	[0.0000840; 0.0006832]	Pa×s	[527.59; 862.34]
η	0.0006832	Pa×s	527.59	Joback Calculated Property
η	0.0004076	Pa×s	583.38	Joback Calculated Property
η	0.0002661	Pa×s	639.17	Joback Calculated Property
η	0.0001861	Pa×s	694.96	Joback Calculated Property
η	0.0001372	Pa×s	750.76	Joback Calculated Property
η	0.0001055	Pa×s	806.55	Joback Calculated Property
η	0.0000840	Pa×s	862.34	Joback Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, 3-chlorophenyl (2-chlorocyclohexyl)methyl ester.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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