Chemical Properties of Diethylaminoethyl diphenylpropionate

InChI

InChI=1S/C21H27NO2/c1-3-22(4-2)15-16-24-21(23)17-20(18-11-7-5-8-12-18)19-13-9-6-10-14-19/h5-14,20H,3-4,15-17H2,1-2H3

InChI Key

ASQMSRQTKSSVSW-UHFFFAOYSA-N

Formula

C21H27NO2

SMILES

CCN(CC)CCOC(=O)CC(c1ccccc1)c1ccccc1

Molecular Weight¹

325.44

• ω : Acentric Factor.
• 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).
• 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	0.7211		Relay (1.0) Calculated Property
ΔfG°	225.18	kJ/mol	Joback Calculated Property
ΔfH°gas	-268.21	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	40.51	kJ/mol	Joback Calculated Property
ΔvapH°	97.07	kJ/mol	Relay (1.0) Calculated Property
IE	8.14	eV	Relay (1.0) Calculated Property
log10WS	-3.87		Relay (1.0) Calculated Property
logPoct/wat	4.094		Crippen Calculated Property
McVol	276.650	ml/mol	McGowan Calculated Property
Pc	1574.70	kPa	Joback Calculated Property
Inp	[2292.00; 2292.00]
Inp	2292.00		NIST
Inp	2292.00		NIST
Tboil	640.08	K	Relay (1.0) Calculated Property
Tc	881.54	K	Relay (1.0) Calculated Property
Tfus	286.68	K	Relay (1.0) Calculated Property
Vc	0.979	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[838.66; 924.17]	J/mol×K	[821.53; 1038.79]
Cp,gas	838.66	J/mol×K	821.53	Joback Calculated Property
Cp,gas	855.88	J/mol×K	857.74	Joback Calculated Property
Cp,gas	871.81	J/mol×K	893.95	Joback Calculated Property
Cp,gas	886.53	J/mol×K	930.16	Joback Calculated Property
Cp,gas	900.11	J/mol×K	966.37	Joback Calculated Property
Cp,gas	912.63	J/mol×K	1002.58	Joback Calculated Property
Cp,gas	924.17	J/mol×K	1038.79	Joback Calculated Property

Similar Compounds

Find more compounds similar to Diethylaminoethyl diphenylpropionate.

Sources

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

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