Chemical Properties of Succinic acid, 2,4,6-trichlorophenyl 4-bromo-2-methoxyphenyl ester

InChI

InChI=1S/C17H12BrCl3O5/c1-24-14-6-9(18)2-3-13(14)25-15(22)4-5-16(23)26-17-11(20)7-10(19)8-12(17)21/h2-3,6-8H,4-5H2,1H3

InChI Key

AFVHWYWUXHUNOK-UHFFFAOYSA-N

Formula

C17H12BrCl3O5

SMILES

COc1cc(Br)ccc1OC(=O)CCC(=O)Oc1c(Cl)cc(Cl)cc1Cl

Molecular Weight¹

482.54

• 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).
• 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
ΔfG°	-325.38	kJ/mol	Joback Calculated Property
ΔfH°gas	-621.21	kJ/mol	Joback Calculated Property
ΔfusH°	50.56	kJ/mol	Joback Calculated Property
ΔvapH°	101.61	kJ/mol	Joback Calculated Property
log10WS	-7.09		Crippen Calculated Property
logPoct/wat	5.709		Crippen Calculated Property
McVol	277.840	ml/mol	McGowan Calculated Property
Pc	2010.90	kPa	Joback Calculated Property
Inp	[3182.00; 3182.00]
Inp	3182.00		NIST
Inp	3182.00		NIST
Tboil	1020.07	K	Joback Calculated Property
Tc	1270.62	K	Joback Calculated Property
Tfus	712.90	K	Joback Calculated Property
Vc	1.046	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[715.08; 732.65]	J/mol×K	[1020.07; 1270.62]
Cp,gas	715.08	J/mol×K	1020.07	Joback Calculated Property
Cp,gas	721.41	J/mol×K	1061.83	Joback Calculated Property
Cp,gas	726.33	J/mol×K	1103.59	Joback Calculated Property
Cp,gas	729.84	J/mol×K	1145.35	Joback Calculated Property
Cp,gas	731.95	J/mol×K	1187.10	Joback Calculated Property
Cp,gas	732.65	J/mol×K	1228.86	Joback Calculated Property
Cp,gas	731.94	J/mol×K	1270.62	Joback Calculated Property
η	[0.0000339; 0.0001414]	Pa×s	[712.90; 1020.07]
η	0.0001414	Pa×s	712.90	Joback Calculated Property
η	0.0001029	Pa×s	764.10	Joback Calculated Property
η	0.0000780	Pa×s	815.29	Joback Calculated Property
η	0.0000610	Pa×s	866.49	Joback Calculated Property
η	0.0000491	Pa×s	917.68	Joback Calculated Property
η	0.0000404	Pa×s	968.88	Joback Calculated Property
η	0.0000339	Pa×s	1020.07	Joback Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, 2,4,6-trichlorophenyl 4-bromo-2-methoxyphenyl ester.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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