Chemical Properties of Glutaric acid, 2-methylpent-3-yl 4-chloro-2-methoxyphenyl ester

InChI

InChI=1S/C18H25ClO5/c1-5-14(12(2)3)23-17(20)7-6-8-18(21)24-15-10-9-13(19)11-16(15)22-4/h9-12,14H,5-8H2,1-4H3

InChI Key

SYGNQICWCXKLAF-UHFFFAOYSA-N

Formula

C18H25ClO5

SMILES

CCC(OC(=O)CCCC(=O)Oc1ccc(Cl)cc1OC)C(C)C

Molecular Weight¹

356.84

• 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	0.8899		Relay (1.0) Calculated Property
ΔfG°	-395.82	kJ/mol	Joback Calculated Property
ΔfH°gas	-969.55	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	39.55	kJ/mol	Joback Calculated Property
ΔvapH°	96.39	kJ/mol	Relay (1.0) Calculated Property
IE	8.18	eV	Relay (1.0) Calculated Property
log10WS	-4.38		Relay (1.0) Calculated Property
logPoct/wat	4.402		Crippen Calculated Property
McVol	273.710	ml/mol	McGowan Calculated Property
Pc	1489.58	kPa	Joback Calculated Property
Inp	[2420.00; 2420.00]
Inp	2420.00		NIST
Inp	2420.00		NIST
Tboil	639.05	K	Relay (1.0) Calculated Property
Tc	840.09	K	Relay (1.0) Calculated Property
Tfus	321.79	K	Relay (1.0) Calculated Property
Vc	0.984	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[816.53; 883.46]	J/mol×K	[859.43; 1068.98]
Cp,gas	816.53	J/mol×K	859.43	Joback Calculated Property
Cp,gas	830.72	J/mol×K	894.36	Joback Calculated Property
Cp,gas	843.69	J/mol×K	929.28	Joback Calculated Property
Cp,gas	855.45	J/mol×K	964.21	Joback Calculated Property
Cp,gas	866.00	J/mol×K	999.13	Joback Calculated Property
Cp,gas	875.33	J/mol×K	1034.06	Joback Calculated Property
Cp,gas	883.46	J/mol×K	1068.98	Joback Calculated Property
η	[0.0000401; 0.0004498]	Pa×s	[510.55; 859.43]
η	0.0004498	Pa×s	510.55	Joback Calculated Property
η	0.0002446	Pa×s	568.70	Joback Calculated Property
η	0.0001489	Pa×s	626.84	Joback Calculated Property
η	0.0000986	Pa×s	684.99	Joback Calculated Property
η	0.0000697	Pa×s	743.14	Joback Calculated Property
η	0.0000518	Pa×s	801.28	Joback Calculated Property
η	0.0000401	Pa×s	859.43	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, 2-methylpent-3-yl 4-chloro-2-methoxyphenyl ester.

Sources

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

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