Chemical Properties of Ethanol, 2,2'-oxybis-, diacetate

InChI

InChI=1S/C8H14O5/c1-7(9)12-5-3-11-4-6-13-8(2)10/h3-6H2,1-2H3

InChI Key

UBPGILLNMDGSDS-UHFFFAOYSA-N

Formula

C8H14O5

SMILES

CC(=O)OCCOCCOC(C)=O

Molecular Weight¹

190.20

Other Names

• Diethylene glycol, diacetate
• Oxydiethylene acetate
• Diglycol, diacetate
• dioxyethylene glycol diacetate
• 2-(2-Acetyloxyethoxy)ethyl acetate
• oxydiethylene di(acetate)

• 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_boilr : Boiling point at reduced pressure (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	0.6592		Relay (1.0) Calculated Property
ΔfG°	-709.26	kJ/mol	Joback Calculated Property
ΔfH°gas	-959.63	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	26.40	kJ/mol	Joback Calculated Property
ΔvapH°	73.68	kJ/mol	Relay (1.0) Calculated Property
IE	9.54	eV	Relay (1.0) Calculated Property
log10WS	-0.30		Relay (1.0) Calculated Property
logPoct/wat	0.129		Crippen Calculated Property
McVol	144.330	ml/mol	McGowan Calculated Property
Pc	2517.59	kPa	Joback Calculated Property
Inp	[1278.00; 1303.00]
Inp	Outlier 1303.00		NIST
Inp	1281.00		NIST
Inp	1278.00		NIST
Inp	1278.00		NIST
Inp	1281.00		NIST
Inp	1282.00		NIST
Inp	1285.00		NIST
Inp	1278.00		NIST
Inp	1282.00		NIST
Inp	1279.00		NIST
Inp	1283.00		NIST
Inp	1280.00		NIST
Inp	1280.00		NIST
Inp	1282.60		NIST
I	[1937.00; 1970.00]
I	1937.00		NIST
I	1970.00		NIST
I	1970.00		NIST
I	1937.00		NIST
I	1970.00		NIST
Tboil	517.26	K	Relay (1.0) Calculated Property
Tc	674.33	K	Relay (1.0) Calculated Property
Tfus	252.65	K	Relay (1.0) Calculated Property
Vc	0.555	m3/kmol	Relay (1.0) Calculated Property

Pressure Dependent Properties

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[223.27; 466.77]	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			7.19340e+01
Coefficient B			5.91040e-01
Coefficient C			-1.11200e-04
Coefficient D			-8.50000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	223.27	J/mol×K	273.00	Calculated Property
Cp,gas	263.35	J/mol×K	353.78	Calculated Property
Cp,gas	300.80	J/mol×K	434.56	Calculated Property
Cp,gas	335.35	J/mol×K	515.33	Calculated Property
Cp,gas	366.74	J/mol×K	596.11	Calculated Property
Cp,gas	394.69	J/mol×K	676.89	Calculated Property
Cp,gas	418.94	J/mol×K	757.67	Calculated Property
Cp,gas	439.22	J/mol×K	838.44	Calculated Property
Cp,gas	455.25	J/mol×K	919.22	Calculated Property
Cp,gas	466.77	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0035040; 0.0002058]	Pa×s	[286.81; 489.21]	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			-1.25060e+01
Coefficient B			1.96525e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			286.81
Temperature range, max.			489.21
η	0.0035040	Pa×s	286.81	Calculated Property
η	0.0021291	Pa×s	309.30	Calculated Property
η	0.0013841	Pa×s	331.79	Calculated Property
η	0.0009503	Pa×s	354.28	Calculated Property
η	0.0006825	Pa×s	376.76	Calculated Property
η	0.0005087	Pa×s	399.25	Calculated Property
η	0.0003913	Pa×s	421.74	Calculated Property
η	0.0003091	Pa×s	444.23	Calculated Property
η	0.0002497	Pa×s	466.72	Calculated Property
η	0.0002058	Pa×s	489.21	Calculated Property

Similar Compounds

Find more compounds similar to Ethanol, 2,2'-oxybis-, diacetate.

Sources

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

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