Chemical Properties of Tripropylene glycol, diacetate

InChI

InChI=1S/C13H24O6/c1-9(17-8-11(3)19-13(5)15)6-16-10(2)7-18-12(4)14/h9-11H,6-8H2,1-5H3

InChI Key

HFNFWZALUXHJQK-UHFFFAOYSA-N

Formula

C13H24O6

SMILES

CC(=O)OCC(C)OCC(C)OCC(C)OC(C)=O

Molecular Weight¹

276.33

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• 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	0.7300		Relay (1.0) Calculated Property
ΔfH°gas	-1231.49	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	29.97	kJ/mol	Joback Calculated Property
ΔvapH°	85.65	kJ/mol	Relay (1.0) Calculated Property
IE	9.26	eV	Relay (1.0) Calculated Property
log10WS	-0.73		Relay (1.0) Calculated Property
logPoct/wat	1.311		Crippen Calculated Property
McVol	220.650	ml/mol	McGowan Calculated Property
Pc	1644.42	kPa	Joback Calculated Property
Inp	[1560.00; 1604.00]
Inp	1598.00		NIST
Inp	1600.00		NIST
Inp	1599.00		NIST
Inp	1598.00		NIST
Inp	1604.00		NIST
Inp	1600.00		NIST
Inp	1598.00		NIST
Inp	1595.00		NIST
Inp	1600.00		NIST
Inp	1596.00		NIST
Inp	1597.00		NIST
Inp	1600.00		NIST
Inp	1602.00		NIST
Inp	1599.00		NIST
Inp	1597.00		NIST
Inp	1560.00		NIST
Inp	1562.00		NIST
Inp	1567.00		NIST
Inp	1572.00		NIST
Inp	1574.00		NIST
Inp	1578.00		NIST
Inp	1560.00		NIST
Inp	1578.00		NIST
Tboil	554.10	K	Relay (1.0) Calculated Property
Tc	703.76	K	Relay (1.0) Calculated Property
Tfus	252.32	K	Relay (1.0) Calculated Property
Vc	0.847	m3/kmol	Relay (1.0) Calculated Property

Cheméo can also estimate Standard Gibbs free energy of formation for this compound, but it falls outside the models' validated range, so it is not shown here. Open the prediction tool to compute it on demand.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[343.80; 744.84]	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			8.78430e+01
Coefficient B			1.02060e+00
Coefficient C			-2.81800e-04
Coefficient D			-8.18000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	343.80	J/mol×K	273.00	Calculated Property
Cp,gas	410.02	J/mol×K	353.78	Calculated Property
Cp,gas	471.42	J/mol×K	434.56	Calculated Property
Cp,gas	527.76	J/mol×K	515.33	Calculated Property
Cp,gas	578.77	J/mol×K	596.11	Calculated Property
Cp,gas	624.19	J/mol×K	676.89	Calculated Property
Cp,gas	663.77	J/mol×K	757.67	Calculated Property
Cp,gas	697.24	J/mol×K	838.44	Calculated Property
Cp,gas	724.35	J/mol×K	919.22	Calculated Property
Cp,gas	744.84	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0037846; 0.0000869]	Pa×s	[320.39; 585.32]	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			-1.39154e+01
Coefficient B			2.67160e+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.			320.39
Temperature range, max.			585.32
η	0.0037846	Pa×s	320.39	Calculated Property
η	0.0018762	Pa×s	349.83	Calculated Property
η	0.0010372	Pa×s	379.26	Calculated Property
η	0.0006245	Pa×s	408.70	Calculated Property
η	0.0004025	Pa×s	438.14	Calculated Property
η	0.0002742	Pa×s	467.57	Calculated Property
η	0.0001955	Pa×s	497.01	Calculated Property
η	0.0001447	Pa×s	526.45	Calculated Property
η	0.0001106	Pa×s	555.88	Calculated Property
η	0.0000869	Pa×s	585.32	Calculated Property

Similar Compounds

Find more compounds similar to Tripropylene glycol, diacetate.

Sources

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

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