Chemical Properties of Glutaric acid, 3-methylbut-2-en-1-yl 2,4-dichloro-1-naphthyl ester

InChI

InChI=1S/C20H20Cl2O4/c1-13(2)10-11-25-18(23)8-5-9-19(24)26-20-15-7-4-3-6-14(15)16(21)12-17(20)22/h3-4,6-7,10,12H,5,8-9,11H2,1-2H3

InChI Key

GEPOIZJZTVXYPJ-UHFFFAOYSA-N

Formula

C20H20Cl2O4

SMILES

CC(C)=CCOC(=O)CCCC(=O)Oc1c(Cl)cc(Cl)c2ccccc12

Molecular Weight¹

395.28

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• 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°	-112.34	kJ/mol	Joback Calculated Property
ΔfH°gas	-476.59	kJ/mol	Joback Calculated Property
ΔfusH°	50.31	kJ/mol	Joback Calculated Property
ΔvapH°	93.14	kJ/mol	Joback Calculated Property
log10WS	-7.02		Crippen Calculated Property
logPoct/wat	5.732		Crippen Calculated Property
McVol	284.500	ml/mol	McGowan Calculated Property
Pc	1559.81	kPa	Joback Calculated Property
Inp	[2972.00; 2972.00]
Inp	2972.00		NIST
Inp	2972.00		NIST
Tboil	949.08	K	Joback Calculated Property
Tc	1179.74	K	Joback Calculated Property
Tfus	596.96	K	Joback Calculated Property
Vc	1.097	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[817.79; 877.17]	J/mol×K	[949.08; 1179.74]
Cp,gas	817.79	J/mol×K	949.08	Joback Calculated Property
Cp,gas	829.76	J/mol×K	987.52	Joback Calculated Property
Cp,gas	840.81	J/mol×K	1025.97	Joback Calculated Property
Cp,gas	851.01	J/mol×K	1064.41	Joback Calculated Property
Cp,gas	860.43	J/mol×K	1102.85	Joback Calculated Property
Cp,gas	869.12	J/mol×K	1141.29	Joback Calculated Property
Cp,gas	877.17	J/mol×K	1179.74	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, 3-methylbut-2-en-1-yl 2,4-dichloro-1-naphthyl ester.

Sources

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

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