Chemical Properties of Succinic acid, 3,4-dimethylphenyl 2-chloroethyl ester

InChI

InChI=1S/C14H17ClO4/c1-10-3-4-12(9-11(10)2)19-14(17)6-5-13(16)18-8-7-15/h3-4,9H,5-8H2,1-2H3

InChI Key

IRCFESCHFFTYDZ-UHFFFAOYSA-N

Formula

C14H17ClO4

SMILES

Cc1ccc(OC(=O)CCC(=O)OCCCl)cc1C

Molecular Weight¹

284.74

• 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	0.7883		Relay (1.0) Calculated Property
ΔfG°	-319.62	kJ/mol	Joback Calculated Property
ΔfH°gas	-756.62	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	35.05	kJ/mol	Joback Calculated Property
ΔvapH°	89.85	kJ/mol	Relay (1.0) Calculated Property
IE	8.45	eV	Relay (1.0) Calculated Property
log10WS	-4.02		Relay (1.0) Calculated Property
logPoct/wat	2.771		Crippen Calculated Property
McVol	211.480	ml/mol	McGowan Calculated Property
Pc	2054.89	kPa	Joback Calculated Property
Inp	[2201.00; 2201.00]
Inp	2201.00		NIST
Inp	2201.00		NIST
Tboil	605.75	K	Relay (1.0) Calculated Property
Tc	827.02	K	Relay (1.0) Calculated Property
Tfus	320.61	K	Relay (1.0) Calculated Property
Vc	0.763	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[564.84; 630.68]	J/mol×K	[746.37; 956.53]
Cp,gas	564.84	J/mol×K	746.37	Joback Calculated Property
Cp,gas	578.06	J/mol×K	781.40	Joback Calculated Property
Cp,gas	590.37	J/mol×K	816.42	Joback Calculated Property
Cp,gas	601.78	J/mol×K	851.45	Joback Calculated Property
Cp,gas	612.31	J/mol×K	886.48	Joback Calculated Property
Cp,gas	621.94	J/mol×K	921.51	Joback Calculated Property
Cp,gas	630.68	J/mol×K	956.53	Joback Calculated Property
η	[0.0001079; 0.0007271]	Pa×s	[473.24; 746.37]
η	0.0007271	Pa×s	473.24	Joback Calculated Property
η	0.0004601	Pa×s	518.76	Joback Calculated Property
η	0.0003135	Pa×s	564.28	Joback Calculated Property
η	0.0002262	Pa×s	609.81	Joback Calculated Property
η	0.0001708	Pa×s	655.33	Joback Calculated Property
η	0.0001337	Pa×s	700.85	Joback Calculated Property
η	0.0001079	Pa×s	746.37	Joback Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, 3,4-dimethylphenyl 2-chloroethyl ester.

Sources

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

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