Chemical Properties of Succinic acid, propyl 2,3,5,6-tetrachlorophenyl ester

InChI

InChI=1S/C13H12Cl4O4/c1-2-5-20-9(18)3-4-10(19)21-13-11(16)7(14)6-8(15)12(13)17/h6H,2-5H2,1H3

InChI Key

PUFCPVAQHPFMDB-UHFFFAOYSA-N

Formula

C13H12Cl4O4

SMILES

CCCOC(=O)CCC(=O)Oc1c(Cl)c(Cl)cc(Cl)c1Cl

Molecular Weight¹

374.04

• 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	0.8226		Relay (1.0) Calculated Property
ΔfG°	-383.09	kJ/mol	Joback Calculated Property
ΔfH°gas	-757.83	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	44.27	kJ/mol	Joback Calculated Property
ΔvapH°	96.00	kJ/mol	Relay (1.0) Calculated Property
IE	8.83	eV	Relay (1.0) Calculated Property
log10WS	-5.73		Relay (1.0) Calculated Property
logPoct/wat	4.939		Crippen Calculated Property
McVol	234.110	ml/mol	McGowan Calculated Property
Pc	1973.55	kPa	Joback Calculated Property
Inp	[2372.00; 2372.00]
Inp	2372.00		NIST
Inp	2372.00		NIST
Tboil	611.58	K	Relay (1.0) Calculated Property
Tc	867.54	K	Relay (1.0) Calculated Property
Tfus	339.34	K	Relay (1.0) Calculated Property
Vc	0.854	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[574.46; 617.13]	J/mol×K	[845.74; 1069.58]
Cp,gas	574.46	J/mol×K	845.74	Joback Calculated Property
Cp,gas	583.87	J/mol×K	883.05	Joback Calculated Property
Cp,gas	592.38	J/mol×K	920.35	Joback Calculated Property
Cp,gas	599.96	J/mol×K	957.66	Joback Calculated Property
Cp,gas	606.62	J/mol×K	994.96	Joback Calculated Property
Cp,gas	612.34	J/mol×K	1032.27	Joback Calculated Property
Cp,gas	617.13	J/mol×K	1069.58	Joback Calculated Property
η	[0.0000852; 0.0003959]	Pa×s	[576.77; 845.74]
η	0.0003959	Pa×s	576.77	Joback Calculated Property
η	0.0002795	Pa×s	621.60	Joback Calculated Property
η	0.0002067	Pa×s	666.43	Joback Calculated Property
η	0.0001589	Pa×s	711.25	Joback Calculated Property
η	0.0001260	Pa×s	756.08	Joback Calculated Property
η	0.0001025	Pa×s	800.91	Joback Calculated Property
η	0.0000852	Pa×s	845.74	Joback Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, propyl 2,3,5,6-tetrachlorophenyl ester.

Sources

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

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