Chemical Properties of Succinic acid, 3,4-dimethylphenyl N,N-diethyl-2-aminoethyl ester

InChI

InChI=1S/C18H27NO4/c1-5-19(6-2)11-12-22-17(20)9-10-18(21)23-16-8-7-14(3)15(4)13-16/h7-8,13H,5-6,9-12H2,1-4H3

InChI Key

JLGLHKDJMKEMRY-UHFFFAOYSA-N

Formula

C18H27NO4

SMILES

CCN(CC)CCOC(=O)CCC(=O)Oc1ccc(C)c(C)c1

Molecular Weight¹

321.41

• 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°	-163.23	kJ/mol	Joback Calculated Property
ΔfH°gas	-623.33	kJ/mol	Joback Calculated Property
ΔfusH°	44.23	kJ/mol	Joback Calculated Property
ΔvapH°	79.62	kJ/mol	Joback Calculated Property
log10WS	-3.52		Crippen Calculated Property
logPoct/wat	2.874		Crippen Calculated Property
McVol	265.580	ml/mol	McGowan Calculated Property
Pc	1531.86	kPa	Joback Calculated Property
Inp	[2428.00; 2428.00]
Inp	2428.00		NIST
Inp	2428.00		NIST
Tboil	812.90	K	Joback Calculated Property
Tc	1012.69	K	Joback Calculated Property
Tfus	520.87	K	Joback Calculated Property
Vc	1.002	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[802.18; 880.30]	J/mol×K	[812.90; 1012.69]
Cp,gas	802.18	J/mol×K	812.90	Joback Calculated Property
Cp,gas	817.81	J/mol×K	846.20	Joback Calculated Property
Cp,gas	832.36	J/mol×K	879.50	Joback Calculated Property
Cp,gas	845.87	J/mol×K	912.79	Joback Calculated Property
Cp,gas	858.35	J/mol×K	946.09	Joback Calculated Property
Cp,gas	869.82	J/mol×K	979.39	Joback Calculated Property
Cp,gas	880.30	J/mol×K	1012.69	Joback Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, 3,4-dimethylphenyl N,N-diethyl-2-aminoethyl ester.

Sources

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

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