Chemical Properties of Succinic acid, 3-methylbut-2-yl 2-chlorophenyl ester

InChI

InChI=1S/C15H19ClO4/c1-10(2)11(3)19-14(17)8-9-15(18)20-13-7-5-4-6-12(13)16/h4-7,10-11H,8-9H2,1-3H3

InChI Key

MESGOKDGYJYNIA-UHFFFAOYSA-N

Formula

C15H19ClO4

SMILES

CC(C)C(C)OC(=O)CCC(=O)Oc1ccccc1Cl

Molecular Weight¹

298.76

• 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	0.7267		Relay (1.0) Calculated Property
ΔfG°	-306.45	kJ/mol	Joback Calculated Property
ΔfH°gas	-770.35	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	30.98	kJ/mol	Joback Calculated Property
ΔvapH°	84.70	kJ/mol	Relay (1.0) Calculated Property
IE	8.68	eV	Relay (1.0) Calculated Property
log10WS	-3.92		Relay (1.0) Calculated Property
logPoct/wat	3.613		Crippen Calculated Property
McVol	225.570	ml/mol	McGowan Calculated Property
Pc	1938.95	kPa	Joback Calculated Property
Inp	[2011.00; 2011.00]
Inp	2011.00		NIST
Inp	2011.00		NIST
Tboil	580.89	K	Relay (1.0) Calculated Property
Tc	807.14	K	Relay (1.0) Calculated Property
Tfus	320.92	K	Relay (1.0) Calculated Property
Vc	0.815	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[621.20; 690.64]	J/mol×K	[763.39; 976.92]
Cp,gas	621.20	J/mol×K	763.39	Joback Calculated Property
Cp,gas	635.31	J/mol×K	798.98	Joback Calculated Property
Cp,gas	648.39	J/mol×K	834.57	Joback Calculated Property
Cp,gas	660.46	J/mol×K	870.16	Joback Calculated Property
Cp,gas	671.51	J/mol×K	905.74	Joback Calculated Property
Cp,gas	681.57	J/mol×K	941.33	Joback Calculated Property
Cp,gas	690.64	J/mol×K	976.92	Joback Calculated Property
η	[0.0000802; 0.0010379]	Pa×s	[441.99; 763.39]
η	0.0010379	Pa×s	441.99	Joback Calculated Property
η	0.0005378	Pa×s	495.56	Joback Calculated Property
η	0.0003168	Pa×s	549.12	Joback Calculated Property
η	0.0002050	Pa×s	602.69	Joback Calculated Property
η	0.0001424	Pa×s	656.26	Joback Calculated Property
η	0.0001046	Pa×s	709.82	Joback Calculated Property
η	0.0000802	Pa×s	763.39	Joback Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, 3-methylbut-2-yl 2-chlorophenyl ester.

Sources

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

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