Chemical Properties of Succinic acid, 4-chloro-3-methylphenyl 3-methylpentyl ester

InChI

InChI=1S/C17H23ClO4/c1-4-12(2)9-10-21-16(19)7-8-17(20)22-14-5-6-15(18)13(3)11-14/h5-6,11-12H,4,7-10H2,1-3H3

InChI Key

GHOGYMIBOSFXHH-UHFFFAOYSA-N

Formula

C17H23ClO4

SMILES

CCC(C)CCOC(=O)CCC(=O)Oc1ccc(Cl)c(C)c1

Molecular Weight¹

326.81

• 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	0.8333		Relay (1.0) Calculated Property
ΔfG°	-296.80	kJ/mol	Joback Calculated Property
ΔfH°gas	-839.64	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	39.30	kJ/mol	Joback Calculated Property
ΔvapH°	92.09	kJ/mol	Relay (1.0) Calculated Property
IE	8.35	eV	Relay (1.0) Calculated Property
log10WS	-5.20		Relay (1.0) Calculated Property
logPoct/wat	4.313		Crippen Calculated Property
McVol	253.750	ml/mol	McGowan Calculated Property
Pc	1618.07	kPa	Joback Calculated Property
Inp	[2347.00; 2347.00]
Inp	2347.00		NIST
Inp	2347.00		NIST
Tboil	622.08	K	Relay (1.0) Calculated Property
Tc	832.51	K	Relay (1.0) Calculated Property
Tfus	303.76	K	Relay (1.0) Calculated Property
Vc	0.916	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[730.92; 801.44]	J/mol×K	[814.57; 1022.39]
Cp,gas	730.92	J/mol×K	814.57	Joback Calculated Property
Cp,gas	745.28	J/mol×K	849.21	Joback Calculated Property
Cp,gas	758.58	J/mol×K	883.84	Joback Calculated Property
Cp,gas	770.83	J/mol×K	918.48	Joback Calculated Property
Cp,gas	782.05	J/mol×K	953.12	Joback Calculated Property
Cp,gas	792.25	J/mol×K	987.76	Joback Calculated Property
Cp,gas	801.44	J/mol×K	1022.39	Joback Calculated Property
η	[0.0000670; 0.0006311]	Pa×s	[492.05; 814.57]
η	0.0006311	Pa×s	492.05	Joback Calculated Property
η	0.0003612	Pa×s	545.80	Joback Calculated Property
η	0.0002285	Pa×s	599.56	Joback Calculated Property
η	0.0001559	Pa×s	653.31	Joback Calculated Property
η	0.0001127	Pa×s	707.06	Joback Calculated Property
η	0.0000853	Pa×s	760.82	Joback Calculated Property
η	0.0000670	Pa×s	814.57	Joback Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, 4-chloro-3-methylphenyl 3-methylpentyl ester.

Sources

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

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