Chemical Properties of Succinic acid, ethyl pentachlorophenyl ester

InChI

InChI=1S/C12H9Cl5O4/c1-2-20-5(18)3-4-6(19)21-12-10(16)8(14)7(13)9(15)11(12)17/h2-4H2,1H3

InChI Key

QKWPHHZXXMWGGK-UHFFFAOYSA-N

Formula

C12H9Cl5O4

SMILES

CCOC(=O)CCC(=O)Oc1c(Cl)c(Cl)c(Cl)c(Cl)c1Cl

Molecular Weight¹

394.46

• 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	0.8145		Relay (1.0) Calculated Property
ΔfG°	-565.97	kJ/mol	Joback Calculated Property
ΔfH°gas	-746.00	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	48.66	kJ/mol	Joback Calculated Property
ΔvapH°	103.49	kJ/mol	Relay (1.0) Calculated Property
IE	8.92	eV	Relay (1.0) Calculated Property
log10WS	-6.28		Relay (1.0) Calculated Property
logPoct/wat	5.202		Crippen Calculated Property
McVol	232.260	ml/mol	McGowan Calculated Property
Pc	1908.57	kPa	Joback Calculated Property
Inp	[2440.00; 2440.00]
Inp	2440.00		NIST
Inp	2440.00		NIST
Tboil	627.23	K	Relay (1.0) Calculated Property
Tc	901.43	K	Relay (1.0) Calculated Property
Tfus	392.43	K	Relay (1.0) Calculated Property
Vc	0.850	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[534.16; 567.12]	J/mol×K	[829.33; 1055.92]
Cp,gas	534.16	J/mol×K	829.33	Joback Calculated Property
Cp,gas	542.07	J/mol×K	867.10	Joback Calculated Property
Cp,gas	549.02	J/mol×K	904.86	Joback Calculated Property
Cp,gas	555.02	J/mol×K	942.63	Joback Calculated Property
Cp,gas	560.04	J/mol×K	980.39	Joback Calculated Property
Cp,gas	564.08	J/mol×K	1018.16	Joback Calculated Property
Cp,gas	567.12	J/mol×K	1055.92	Joback Calculated Property
η	[0.0000657; 0.0003836]	Pa×s	[548.28; 829.33]
η	0.0003836	Pa×s	548.28	Joback Calculated Property
η	0.0002547	Pa×s	595.12	Joback Calculated Property
η	0.0001795	Pa×s	641.96	Joback Calculated Property
η	0.0001327	Pa×s	688.80	Joback Calculated Property
η	0.0001019	Pa×s	735.65	Joback Calculated Property
η	0.0000808	Pa×s	782.49	Joback Calculated Property
η	0.0000657	Pa×s	829.33	Joback Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, ethyl pentachlorophenyl ester.

Sources

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

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