Chemical Properties of Succinic acid, 2,4,6-trichlorophenyl 1-phenylpropyl ester

InChI

InChI=1S/C19H17Cl3O4/c1-2-16(12-6-4-3-5-7-12)25-17(23)8-9-18(24)26-19-14(21)10-13(20)11-15(19)22/h3-7,10-11,16H,2,8-9H2,1H3

InChI Key

WXGKPRCZBVQDOG-UHFFFAOYSA-N

Formula

C19H17Cl3O4

SMILES

CCC(OC(=O)CCC(=O)Oc1c(Cl)cc(Cl)cc1Cl)c1ccccc1

Molecular Weight¹

415.69

• 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	0.8440		Relay (1.0) Calculated Property
ΔfG°	-201.04	kJ/mol	Joback Calculated Property
ΔfH°gas	-632.42	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	46.52	kJ/mol	Joback Calculated Property
ΔvapH°	115.46	kJ/mol	Relay (1.0) Calculated Property
IE	8.58	eV	Relay (1.0) Calculated Property
log10WS	-5.90		Relay (1.0) Calculated Property
logPoct/wat	6.027		Crippen Calculated Property
McVol	282.650	ml/mol	McGowan Calculated Property
Pc	1685.18	kPa	Joback Calculated Property
Inp	[2738.00; 2738.00]
Inp	2738.00		NIST
Inp	2738.00		NIST
Tboil	643.20	K	Relay (1.0) Calculated Property
Tc	938.10	K	Relay (1.0) Calculated Property
Tfus	356.44	K	Relay (1.0) Calculated Property
Vc	1.001	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[785.56; 825.67]	J/mol×K	[966.85; 1206.89]
Cp,gas	785.56	J/mol×K	966.85	Joback Calculated Property
Cp,gas	795.36	J/mol×K	1006.86	Joback Calculated Property
Cp,gas	803.87	J/mol×K	1046.86	Joback Calculated Property
Cp,gas	811.12	J/mol×K	1086.87	Joback Calculated Property
Cp,gas	817.15	J/mol×K	1126.88	Joback Calculated Property
Cp,gas	821.99	J/mol×K	1166.89	Joback Calculated Property
Cp,gas	825.67	J/mol×K	1206.89	Joback Calculated Property
η	[0.0000389; 0.0002781]	Pa×s	[613.37; 966.85]
η	0.0002781	Pa×s	613.37	Joback Calculated Property
η	0.0001735	Pa×s	672.28	Joback Calculated Property
η	0.0001168	Pa×s	731.20	Joback Calculated Property
η	0.0000834	Pa×s	790.11	Joback Calculated Property
η	0.0000624	Pa×s	849.02	Joback Calculated Property
η	0.0000485	Pa×s	907.94	Joback Calculated Property
η	0.0000389	Pa×s	966.85	Joback Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, 2,4,6-trichlorophenyl 1-phenylpropyl ester.

Sources

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

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