Chemical Properties of Succinic acid, but-3-yn-2-yl 2,2-dichloroethyl ester

InChI

InChI=1S/C10H12Cl2O4/c1-3-7(2)16-10(14)5-4-9(13)15-6-8(11)12/h1,7-8H,4-6H2,2H3

InChI Key

XFZHGSZTCPIFDY-UHFFFAOYSA-N

Formula

C10H12Cl2O4

SMILES

C#CC(C)OC(=O)CCC(=O)OCC(Cl)Cl

Molecular Weight¹

267.11

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• 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°	-240.19	kJ/mol	Joback Calculated Property
ΔfH°gas	-489.47	kJ/mol	Joback Calculated Property
ΔfusH°	31.55	kJ/mol	Joback Calculated Property
ΔvapH°	64.02	kJ/mol	Joback Calculated Property
log10WS	-2.55		Crippen Calculated Property
logPoct/wat	1.678		Crippen Calculated Property
McVol	182.520	ml/mol	McGowan Calculated Property
Pc	2510.03	kPa	Joback Calculated Property
Inp	[1632.00; 1632.00]
Inp	1632.00		NIST
Inp	1632.00		NIST
Tboil	644.88	K	Joback Calculated Property
Tc	851.37	K	Joback Calculated Property
Tfus	423.59	K	Joback Calculated Property
Vc	0.692	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[426.78; 483.43]	J/mol×K	[644.88; 851.37]
Cp,gas	426.78	J/mol×K	644.88	Joback Calculated Property
Cp,gas	437.82	J/mol×K	679.29	Joback Calculated Property
Cp,gas	448.22	J/mol×K	713.71	Joback Calculated Property
Cp,gas	457.97	J/mol×K	748.12	Joback Calculated Property
Cp,gas	467.09	J/mol×K	782.54	Joback Calculated Property
Cp,gas	475.58	J/mol×K	816.95	Joback Calculated Property
Cp,gas	483.43	J/mol×K	851.37	Joback Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, but-3-yn-2-yl 2,2-dichloroethyl ester.

Sources

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

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