Chemical Properties of 1,1,3-Triethoxybutane (CAS 5870-82-6)

InChI

InChI=1S/C10H22O3/c1-5-11-9(4)8-10(12-6-2)13-7-3/h9-10H,5-8H2,1-4H3

InChI Key

MDIBXLWYZGZAKL-UHFFFAOYSA-N

Formula

C10H22O3

SMILES

CCOC(C)CC(OCC)OCC

Molecular Weight¹

190.28

CAS

5870-82-6

• 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 : Polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Critical Volume, Standard Gibbs free energy of formation, Acentric Factor for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[263.20; 591.81]	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			6.69340e+01
Coefficient B			7.76080e-01
Coefficient C			-1.93600e-04
Coefficient D			-5.76000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	263.20	J/mol×K	273.00	Calculated Property
Cp,gas	314.71	J/mol×K	353.78	Calculated Property
Cp,gas	362.90	J/mol×K	434.56	Calculated Property
Cp,gas	407.58	J/mol×K	515.33	Calculated Property
Cp,gas	448.57	J/mol×K	596.11	Calculated Property
Cp,gas	485.69	J/mol×K	676.89	Calculated Property
Cp,gas	518.75	J/mol×K	757.67	Calculated Property
Cp,gas	547.58	J/mol×K	838.44	Calculated Property
Cp,gas	572.00	J/mol×K	919.22	Calculated Property
Cp,gas	591.81	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0048621; 0.0001563]	Pa×s	[239.15; 464.67]	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			-1.24095e+01
Coefficient B			1.69395e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			239.15
Temperature range, max.			464.67
η	0.0048621	Pa×s	239.15	Calculated Property
η	0.0024836	Pa×s	264.21	Calculated Property
η	0.0014252	Pa×s	289.27	Calculated Property
η	0.0008936	Pa×s	314.32	Calculated Property
η	0.0006002	Pa×s	339.38	Calculated Property
η	0.0004259	Pa×s	364.44	Calculated Property
η	0.0003158	Pa×s	389.50	Calculated Property
η	0.0002428	Pa×s	414.56	Calculated Property
η	0.0001923	Pa×s	439.61	Calculated Property
η	0.0001563	Pa×s	464.67	Calculated Property

Similar Compounds

Find more compounds similar to 1,1,3-Triethoxybutane.

Sources

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

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