Chemical Properties of Glutaric acid, hexa-1,5-dien-3-yl 2,3-dichlorophenyl ester

InChI

InChI=1S/C17H18Cl2O4/c1-3-7-12(4-2)22-15(20)10-6-11-16(21)23-14-9-5-8-13(18)17(14)19/h3-5,8-9,12H,1-2,6-7,10-11H2

InChI Key

LJDKWWGEZLJZHU-UHFFFAOYSA-N

Formula

C17H18Cl2O4

SMILES

C=CCC(C=C)OC(=O)CCCC(=O)Oc1cccc(Cl)c1Cl

Molecular Weight¹

357.23

• 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	0.7736		Relay (... Calculated Property
ΔfG°	-133.05	kJ/mol	Joback Calculated Property
ΔfH°gas	-648.63	kJ/mol	Relay (... Calculated Property
ΔfusH°	40.93	kJ/mol	Joback Calculated Property
ΔvapH°	98.81	kJ/mol	Relay (... Calculated Property
IE	8.70	eV	Relay (... Calculated Property
log10WS	-4.68		Relay (... Calculated Property
logPoct/wat	4.743		Crippen Calculated Property
McVol	257.390	ml/mol	McGowan Calculated Property
Pc	1681.03	kPa	Joback Calculated Property
Inp	[2400.00; 2400.00]
Inp	2400.00		NIST
Inp	2400.00		NIST
Tboil	646.16	K	Relay (... Calculated Property
Tc	857.96	K	Relay (... Calculated Property
Tfus	298.10	K	Relay (... Calculated Property
Vc	0.886	m3/kmol	Relay (... Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[701.68; 760.09]	J/mol×K	[845.36; 1061.92]
Cp,gas	701.68	J/mol×K	845.36	Joback Calculated Property
Cp,gas	713.85	J/mol×K	881.45	Joback Calculated Property
Cp,gas	725.01	J/mol×K	917.55	Joback Calculated Property
Cp,gas	735.19	J/mol×K	953.64	Joback Calculated Property
Cp,gas	744.41	J/mol×K	989.73	Joback Calculated Property
Cp,gas	752.70	J/mol×K	1025.82	Joback Calculated Property
Cp,gas	760.09	J/mol×K	1061.92	Joback Calculated Property
η	[0.0000665; 0.0005484]	Pa×s	[518.45; 845.36]
η	0.0005484	Pa×s	518.45	Joback Calculated Property
η	0.0003264	Pa×s	572.94	Joback Calculated Property
η	0.0002126	Pa×s	627.42	Joback Calculated Property
η	0.0001483	Pa×s	681.90	Joback Calculated Property
η	0.0001091	Pa×s	736.39	Joback Calculated Property
η	0.0000837	Pa×s	790.88	Joback Calculated Property
η	0.0000665	Pa×s	845.36	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, hexa-1,5-dien-3-yl 2,3-dichlorophenyl ester.

Sources

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

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