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

InChI

InChI=1S/C16H21ClO4/c1-3-4-10-20-15(18)6-5-7-16(19)21-14-9-8-13(17)11-12(14)2/h8-9,11H,3-7,10H2,1-2H3

InChI Key

NZOGZWIWAHAYKX-UHFFFAOYSA-N

Formula

C16H21ClO4

SMILES

CCCCOC(=O)CCCC(=O)Oc1ccc(Cl)cc1C

Molecular Weight¹

312.79

• 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	0.8458		Relay (... Calculated Property
ΔfG°	-302.78	kJ/mol	Joback Calculated Property
ΔfH°gas	-795.67	kJ/mol	Relay (... Calculated Property
ΔfusH°	40.23	kJ/mol	Joback Calculated Property
ΔvapH°	91.82	kJ/mol	Relay (... Calculated Property
IE	8.35	eV	Relay (... Calculated Property
log10WS	-4.47		Relay (... Calculated Property
logPoct/wat	4.067		Crippen Calculated Property
McVol	239.660	ml/mol	McGowan Calculated Property
Pc	1739.01	kPa	Joback Calculated Property
Inp	[2284.00; 2284.00]
Inp	2284.00		NIST
Inp	2284.00		NIST
Tboil	619.88	K	Relay (... Calculated Property
Tc	817.40	K	Relay (... Calculated Property
Tfus	284.06	K	Relay (... Calculated Property
Vc	0.885	m3/kmol	Relay (... Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[674.17; 743.12]	J/mol×K	[792.13; 998.52]
Cp,gas	674.17	J/mol×K	792.13	Joback Calculated Property
Cp,gas	688.09	J/mol×K	826.53	Joback Calculated Property
Cp,gas	701.02	J/mol×K	860.93	Joback Calculated Property
Cp,gas	712.98	J/mol×K	895.32	Joback Calculated Property
Cp,gas	723.98	J/mol×K	929.72	Joback Calculated Property
Cp,gas	734.02	J/mol×K	964.12	Joback Calculated Property
Cp,gas	743.12	J/mol×K	998.52	Joback Calculated Property
η	[0.0000834; 0.0006188]	Pa×s	[495.78; 792.13]
η	0.0006188	Pa×s	495.78	Joback Calculated Property
η	0.0003809	Pa×s	545.17	Joback Calculated Property
η	0.0002541	Pa×s	594.56	Joback Calculated Property
η	0.0001804	Pa×s	643.96	Joback Calculated Property
η	0.0001345	Pa×s	693.35	Joback Calculated Property
η	0.0001042	Pa×s	742.74	Joback Calculated Property
η	0.0000834	Pa×s	792.13	Joback Calculated Property

Similar Compounds

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

Sources

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

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