Chemical Properties of Succinic acid, pentadecyl 2,3,6-trichlorophenyl ester

InChI

InChI=1S/C25H37Cl3O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-19-31-22(29)17-18-23(30)32-25-21(27)16-15-20(26)24(25)28/h15-16H,2-14,17-19H2,1H3

InChI Key

BYEZQRLTMPJVRB-UHFFFAOYSA-N

Formula

C25H37Cl3O4

SMILES

CCCCCCCCCCCCCCCOC(=O)CCC(=O)Oc1c(Cl)ccc(Cl)c1Cl

Molecular Weight¹

507.92

• 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	1.2446		Relay (1.0) Calculated Property
ΔfG°	-260.49	kJ/mol	Joback Calculated Property
ΔfH°gas	-1001.82	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	71.55	kJ/mol	Joback Calculated Property
ΔvapH°	137.20	kJ/mol	Relay (1.0) Calculated Property
IE	8.83	eV	Relay (1.0) Calculated Property
log10WS	-8.67		Relay (1.0) Calculated Property
logPoct/wat	8.967		Crippen Calculated Property
McVol	390.950	ml/mol	McGowan Calculated Property
Pc	890.54	kPa	Joback Calculated Property
Inp	[3451.00; 3451.00]
Inp	3451.00		NIST
Inp	3451.00		NIST
Tboil	682.63	K	Relay (1.0) Calculated Property
Tc	929.95	K	Relay (1.0) Calculated Property
Tfus	336.35	K	Relay (1.0) Calculated Property
Vc	1.461	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1251.67; 1307.36]	J/mol×K	[1077.89; 1323.48]
Cp,gas	1251.67	J/mol×K	1077.89	Joback Calculated Property
Cp,gas	1265.04	J/mol×K	1118.82	Joback Calculated Property
Cp,gas	1276.70	J/mol×K	1159.75	Joback Calculated Property
Cp,gas	1286.70	J/mol×K	1200.69	Joback Calculated Property
Cp,gas	1295.11	J/mol×K	1241.62	Joback Calculated Property
Cp,gas	1301.98	J/mol×K	1282.55	Joback Calculated Property
Cp,gas	1307.36	J/mol×K	1323.48	Joback Calculated Property
η	[0.0000163; 0.0001395]	Pa×s	[669.57; 1077.89]
η	0.0001395	Pa×s	669.57	Joback Calculated Property
η	0.0000827	Pa×s	737.62	Joback Calculated Property
η	0.0000536	Pa×s	805.68	Joback Calculated Property
η	0.0000371	Pa×s	873.73	Joback Calculated Property
η	0.0000271	Pa×s	941.78	Joback Calculated Property
η	0.0000207	Pa×s	1009.84	Joback Calculated Property
η	0.0000163	Pa×s	1077.89	Joback Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, pentadecyl 2,3,6-trichlorophenyl ester.

Sources

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

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