Chemical Properties of Fumaric acid, 2,6-dichlorophenyl 3-chlorophenyl ester

InChI

InChI=1S/C16H9Cl3O4/c17-10-3-1-4-11(9-10)22-14(20)7-8-15(21)23-16-12(18)5-2-6-13(16)19/h1-9H/b8-7+

InChI Key

WUPTYAPXYVSYDZ-BQYQJAHWSA-N

Formula

C16H9Cl3O4

SMILES

O=C(C=CC(=O)Oc1c(Cl)cccc1Cl)Oc1cccc(Cl)c1

Molecular Weight¹

371.60

• 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°	-143.64	kJ/mol	Joback Calculated Property
ΔfH°gas	-354.52	kJ/mol	Joback Calculated Property
ΔfusH°	42.48	kJ/mol	Joback Calculated Property
ΔvapH°	89.17	kJ/mol	Joback Calculated Property
log10WS	-5.66		Crippen Calculated Property
logPoct/wat	4.714		Crippen Calculated Property
McVol	236.080	ml/mol	McGowan Calculated Property
Pc	2258.96	kPa	Joback Calculated Property
Inp	[2616.00; 2616.00]
Inp	2616.00		NIST
Inp	2616.00		NIST
Tboil	902.81	K	Joback Calculated Property
Tc	1154.56	K	Joback Calculated Property
Tfus	589.48	K	Joback Calculated Property
Vc	0.890	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[589.02; 626.94]	J/mol×K	[902.81; 1154.56]
Cp,gas	589.02	J/mol×K	902.81	Joback Calculated Property
Cp,gas	597.86	J/mol×K	944.77	Joback Calculated Property
Cp,gas	605.64	J/mol×K	986.73	Joback Calculated Property
Cp,gas	612.39	J/mol×K	1028.69	Joback Calculated Property
Cp,gas	618.16	J/mol×K	1070.65	Joback Calculated Property
Cp,gas	622.99	J/mol×K	1112.60	Joback Calculated Property
Cp,gas	626.94	J/mol×K	1154.56	Joback Calculated Property
η	[0.0000577; 0.0003288]	Pa×s	[589.48; 902.81]
η	0.0003288	Pa×s	589.48	Joback Calculated Property
η	0.0002186	Pa×s	641.70	Joback Calculated Property
η	0.0001545	Pa×s	693.92	Joback Calculated Property
η	0.0001147	Pa×s	746.14	Joback Calculated Property
η	0.0000885	Pa×s	798.37	Joback Calculated Property
η	0.0000705	Pa×s	850.59	Joback Calculated Property
η	0.0000577	Pa×s	902.81	Joback Calculated Property

Similar Compounds

Find more compounds similar to Fumaric acid, 2,6-dichlorophenyl 3-chlorophenyl ester.

Sources

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

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