Chemical Properties of Succinic acid, 2-ethylhexyl pentachlorophenyl ester

InChI

InChI=1S/C18H21Cl5O4/c1-3-5-6-10(4-2)9-26-11(24)7-8-12(25)27-18-16(22)14(20)13(19)15(21)17(18)23/h10H,3-9H2,1-2H3

InChI Key

OVNZPJVQRKXMTR-UHFFFAOYSA-N

Formula

C18H21Cl5O4

SMILES

CCCCC(CC)COC(=O)CCC(=O)Oc1c(Cl)c(Cl)c(Cl)c(Cl)c1Cl

Molecular Weight¹

478.62

• 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	0.9895		Relay (1.0) Calculated Property
ΔfG°	-364.99	kJ/mol	Joback Calculated Property
ΔfH°gas	-873.20	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	57.51	kJ/mol	Joback Calculated Property
ΔvapH°	117.83	kJ/mol	Relay (1.0) Calculated Property
IE	8.75	eV	Relay (1.0) Calculated Property
log10WS	-8.11		Relay (1.0) Calculated Property
logPoct/wat	7.399		Crippen Calculated Property
McVol	316.800	ml/mol	McGowan Calculated Property
Pc	1298.60	kPa	Joback Calculated Property
Inp	[2958.00; 2958.00]
Inp	2958.00		NIST
Inp	2958.00		NIST
Tboil	669.63	K	Relay (1.0) Calculated Property
Tc	935.29	K	Relay (1.0) Calculated Property
Tfus	338.58	K	Relay (1.0) Calculated Property
Vc	1.139	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[871.72; 909.04]	J/mol×K	[1002.11; 1231.88]
Cp,gas	871.72	J/mol×K	1002.11	Joback Calculated Property
Cp,gas	881.09	J/mol×K	1040.41	Joback Calculated Property
Cp,gas	889.18	J/mol×K	1078.70	Joback Calculated Property
Cp,gas	896.02	J/mol×K	1117.00	Joback Calculated Property
Cp,gas	901.60	J/mol×K	1155.29	Joback Calculated Property
Cp,gas	905.94	J/mol×K	1193.59	Joback Calculated Property
Cp,gas	909.04	J/mol×K	1231.88	Joback Calculated Property
η	[0.0000324; 0.0001883]	Pa×s	[660.56; 1002.11]
η	0.0001883	Pa×s	660.56	Joback Calculated Property
η	0.0001249	Pa×s	717.48	Joback Calculated Property
η	0.0000881	Pa×s	774.41	Joback Calculated Property
η	0.0000651	Pa×s	831.33	Joback Calculated Property
η	0.0000501	Pa×s	888.26	Joback Calculated Property
η	0.0000397	Pa×s	945.18	Joback Calculated Property
η	0.0000324	Pa×s	1002.11	Joback Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, 2-ethylhexyl pentachlorophenyl ester.

Sources

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

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