Chemical Properties of Ethanol, 2-phenoxy-, propanoate (CAS 23495-12-7)

InChI

InChI=1S/C11H14O3/c1-2-11(12)14-9-8-13-10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H3

InChI Key

FKTSMIXZGPUSJB-UHFFFAOYSA-N

Formula

C11H14O3

SMILES

CCC(=O)OCCOc1ccccc1

Molecular Weight¹

194.23

CAS

23495-12-7

Other Names

• Ethanol, 2-phenoxy-, propionate
• 2-Phenoxyethyl propionate
• Ethyleneglycol monophenyl ether propionate
• Propionic acid, 2-phenoxyethyl ester
• 2-Phenoxyethanol propionate
• Phenyloxyethyl propionate

• 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.
• I : 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	0.6060		Relay (1.0) Calculated Property
ΔfG°	-261.22	kJ/mol	Joback Calculated Property
ΔfH°gas	-462.47	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	23.84	kJ/mol	Joback Calculated Property
ΔvapH°	77.42	kJ/mol	Relay (1.0) Calculated Property
IE	8.52	eV	Relay (1.0) Calculated Property
log10WS	-2.27		Relay (1.0) Calculated Property
logPoct/wat	2.019		Crippen Calculated Property
McVol	155.400	ml/mol	McGowan Calculated Property
Pc	2616.41	kPa	Joback Calculated Property
Inp	[1436.00; 1447.00]
Inp	1436.00		NIST
Inp	1447.00		NIST
Inp	1447.00		NIST
Inp	1436.00		NIST
I	[2126.00; 2126.00]
I	2126.00		NIST
I	2126.00		NIST
Tboil	539.37	K	Relay (1.0) Calculated Property
Tc	734.01	K	Relay (1.0) Calculated Property
Tfus	283.29	K	Relay (1.0) Calculated Property
Vc	0.584	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[366.70; 441.80]	J/mol×K	[558.60; 763.29]
Cp,gas	366.70	J/mol×K	558.60	Joback Calculated Property
Cp,gas	381.18	J/mol×K	592.71	Joback Calculated Property
Cp,gas	394.86	J/mol×K	626.83	Joback Calculated Property
Cp,gas	407.75	J/mol×K	660.94	Joback Calculated Property
Cp,gas	419.87	J/mol×K	695.06	Joback Calculated Property
Cp,gas	431.22	J/mol×K	729.17	Joback Calculated Property
Cp,gas	441.80	J/mol×K	763.29	Joback Calculated Property
η	[0.0001488; 0.0024995]	Pa×s	[304.71; 558.60]
η	0.0024995	Pa×s	304.71	Joback Calculated Property
η	0.0011726	Pa×s	347.03	Joback Calculated Property
η	0.0006485	Pa×s	389.34	Joback Calculated Property
η	0.0004028	Pa×s	431.65	Joback Calculated Property
η	0.0002724	Pa×s	473.97	Joback Calculated Property
η	0.0001964	Pa×s	516.28	Joback Calculated Property
η	0.0001488	Pa×s	558.60	Joback Calculated Property

Similar Compounds

Find more compounds similar to Ethanol, 2-phenoxy-, propanoate.

Sources

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

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