Chemical Properties of 2-(2-butoxyethoxy)ethanone

InChI

InChI=1S/C9H18O3/c1-2-3-4-6-11-8-9-12-7-5-10/h5H,2-4,6-9H2,1H3

InChI Key

UCZDUPYLMYTAMD-UHFFFAOYSA-N

Formula

C9H18O3

SMILES

CCCCCOCCOCC=O

Molecular Weight¹

174.24

• 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_p : 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	0.6334		Relay (1.0) Calculated Property
ΔfG°	-284.62	kJ/mol	Joback Calculated Property
ΔfH°gas	-564.90	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	23.73	kJ/mol	Joback Calculated Property
ΔvapH°	60.85	kJ/mol	Relay (1.0) Calculated Property
IE	9.64	eV	Relay (1.0) Calculated Property
log10WS	-1.01		Relay (1.0) Calculated Property
logPoct/wat	1.409		Crippen Calculated Property
McVol	150.980	ml/mol	McGowan Calculated Property
Pc	2398.22	kPa	Joback Calculated Property
Ip	[1778.00; 1778.00]
Ip	1778.00		NIST
Ip	1778.00		NIST
Ip	1778.00		NIST
Tboil	501.78	K	Relay (1.0) Calculated Property
Tc	686.51	K	Relay (1.0) Calculated Property
Tfus	237.82	K	Relay (1.0) Calculated Property
Vc	0.568	m3/kmol	Relay (1.0) Calculated Property

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[232.13; 511.43]	J/mol×K	[273.00; 1000.00]	Joback Predicted correlation
Equation			Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K
Coefficient A			5.71070e+01
Coefficient B			7.06920e-01
Coefficient C			-2.36800e-04
Coefficient D			-1.58000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	232.13	J/mol×K	273.00	Calculated Property
Cp,gas	276.86	J/mol×K	353.78	Calculated Property
Cp,gas	318.29	J/mol×K	434.56	Calculated Property
Cp,gas	356.36	J/mol×K	515.33	Calculated Property
Cp,gas	391.02	J/mol×K	596.11	Calculated Property
Cp,gas	422.22	J/mol×K	676.89	Calculated Property
Cp,gas	449.91	J/mol×K	757.67	Calculated Property
Cp,gas	474.04	J/mol×K	838.44	Calculated Property
Cp,gas	494.56	J/mol×K	919.22	Calculated Property
Cp,gas	511.43	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0027531; 0.0002667]	Pa×s	[277.65; 467.75]	Joback Predicted correlation
Equation			Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K
Coefficient A			-1.16386e+01
Coefficient B			1.59469e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Comment			Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc.
Temperature range, min.			277.65
Temperature range, max.			467.75
η	0.0027531	Pa×s	277.65	Calculated Property
η	0.0018343	Pa×s	298.77	Calculated Property
η	0.0012895	Pa×s	319.89	Calculated Property
η	0.0009469	Pa×s	341.02	Calculated Property
η	0.0007209	Pa×s	362.14	Calculated Property
η	0.0005655	Pa×s	383.26	Calculated Property
η	0.0004551	Pa×s	404.38	Calculated Property
η	0.0003742	Pa×s	425.51	Calculated Property
η	0.0003134	Pa×s	446.63	Calculated Property
η	0.0002667	Pa×s	467.75	Calculated Property

Similar Compounds

Find more compounds similar to 2-(2-butoxyethoxy)ethanone.

Sources

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

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