Chemical Properties of Succinic acid, 2,2-dichloroethyl 3-methylpentyl ester

InChI

InChI=1S/C12H20Cl2O4/c1-3-9(2)6-7-17-11(15)4-5-12(16)18-8-10(13)14/h9-10H,3-8H2,1-2H3

InChI Key

LTCGAETWNPBOBW-UHFFFAOYSA-N

Formula

C12H20Cl2O4

SMILES

CCC(C)CCOC(=O)CCC(=O)OCC(Cl)Cl

Molecular Weight¹

299.19

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• 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).
• 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).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfH°gas	-966.29	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	36.92	kJ/mol	Joback Calculated Property
ΔvapH°	81.52	kJ/mol	Relay (1.0) Calculated Property
logPoct/wat	3.093		Crippen Calculated Property
McVol	219.300	ml/mol	McGowan Calculated Property
Pc	1710.36	kPa	Joback Calculated Property
Inp	[1862.00; 1862.00]
Inp	1862.00		NIST
Inp	1862.00		NIST
Tboil	574.09	K	Relay (1.0) Calculated Property
Tc	757.28	K	Relay (1.0) Calculated Property

Cheméo can also estimate Normal melting (fusion) point, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[564.44; 635.68]	J/mol×K	[664.58; 851.63]
Cp,gas	564.44	J/mol×K	664.58	Joback Calculated Property
Cp,gas	578.31	J/mol×K	695.75	Joback Calculated Property
Cp,gas	591.37	J/mol×K	726.93	Joback Calculated Property
Cp,gas	603.63	J/mol×K	758.10	Joback Calculated Property
Cp,gas	615.10	J/mol×K	789.28	Joback Calculated Property
Cp,gas	625.78	J/mol×K	820.45	Joback Calculated Property
Cp,gas	635.68	J/mol×K	851.63	Joback Calculated Property
η	[0.0000870; 0.0038936]	Pa×s	[339.50; 664.58]
η	0.0038936	Pa×s	339.50	Joback Calculated Property
η	0.0013363	Pa×s	393.68	Joback Calculated Property
η	0.0005941	Pa×s	447.86	Joback Calculated Property
η	0.0003146	Pa×s	502.04	Joback Calculated Property
η	0.0001886	Pa×s	556.22	Joback Calculated Property
η	0.0001238	Pa×s	610.40	Joback Calculated Property
η	0.0000870	Pa×s	664.58	Joback Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, 2,2-dichloroethyl 3-methylpentyl ester.

Sources

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

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
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