Chemical Properties of Glutaric acid, cyclohexylmethyl 2-methyl-4-chlorophenyl ester

InChI

InChI=1S/C19H25ClO4/c1-14-12-16(20)10-11-17(14)24-19(22)9-5-8-18(21)23-13-15-6-3-2-4-7-15/h10-12,15H,2-9,13H2,1H3

InChI Key

NQTTVJBYPCWDEI-UHFFFAOYSA-N

Formula

C19H25ClO4

SMILES

Cc1cc(Cl)ccc1OC(=O)CCCC(=O)OCC1CCCCC1

Molecular Weight¹

352.85

• 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°	-253.07	kJ/mol	Joback Calculated Property
ΔfH°gas	-672.92	kJ/mol	Joback Calculated Property
ΔfusH°	39.83	kJ/mol	Joback Calculated Property
ΔvapH°	84.61	kJ/mol	Joback Calculated Property
log10WS	-5.65		Crippen Calculated Property
logPoct/wat	4.848		Crippen Calculated Property
McVol	271.070	ml/mol	McGowan Calculated Property
Pc	1624.60	kPa	Joback Calculated Property
Inp	[2672.00; 2672.00]
Inp	2672.00		NIST
Inp	2672.00		NIST
Tboil	880.32	K	Joback Calculated Property
Tc	1105.43	K	Joback Calculated Property
Tfus	536.97	K	Joback Calculated Property
Vc	1.022	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[839.57; 909.89]	J/mol×K	[880.32; 1105.43]
Cp,gas	839.57	J/mol×K	880.32	Joback Calculated Property
Cp,gas	854.90	J/mol×K	917.84	Joback Calculated Property
Cp,gas	868.74	J/mol×K	955.36	Joback Calculated Property
Cp,gas	881.14	J/mol×K	992.88	Joback Calculated Property
Cp,gas	892.11	J/mol×K	1030.40	Joback Calculated Property
Cp,gas	901.69	J/mol×K	1067.91	Joback Calculated Property
Cp,gas	909.89	J/mol×K	1105.43	Joback Calculated Property
η	[0.0000573; 0.0005300]	Pa×s	[536.97; 880.32]
η	0.0005300	Pa×s	536.97	Joback Calculated Property
η	0.0003060	Pa×s	594.20	Joback Calculated Property
η	0.0001946	Pa×s	651.42	Joback Calculated Property
η	0.0001331	Pa×s	708.64	Joback Calculated Property
η	0.0000964	Pa×s	765.87	Joback Calculated Property
η	0.0000730	Pa×s	823.10	Joback Calculated Property
η	0.0000573	Pa×s	880.32	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, cyclohexylmethyl 2-methyl-4-chlorophenyl ester.

Sources

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

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