Chemical Properties of 1,3-Butadiene, 1-ethoxy-, (E) (CAS 19774-34-6)

InChI

InChI=1S/C6H10O/c1-3-5-6-7-4-2/h3,5-6H,1,4H2,2H3/b6-5+

InChI Key

LDVKFLIDEBQMNX-AATRIKPKSA-N

Formula

C6H10O

SMILES

C=CC=COCC

Molecular Weight¹

98.14

CAS

19774-34-6

• 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).
• 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 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	[124.36; 288.28]	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			5.76100e+00
Coefficient B			5.10620e-01
Coefficient C			-2.98300e-04
Coefficient D			7.02000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	124.36	J/mol×K	273.00	Calculated Property
Cp,gas	152.18	J/mol×K	353.78	Calculated Property
Cp,gas	177.08	J/mol×K	434.56	Calculated Property
Cp,gas	199.29	J/mol×K	515.33	Calculated Property
Cp,gas	219.02	J/mol×K	596.11	Calculated Property
Cp,gas	236.49	J/mol×K	676.89	Calculated Property
Cp,gas	251.93	J/mol×K	757.67	Calculated Property
Cp,gas	265.56	J/mol×K	838.44	Calculated Property
Cp,gas	277.61	J/mol×K	919.22	Calculated Property
Cp,gas	288.28	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0026699; 0.0001555]	Pa×s	[172.77; 376.07]	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			-1.11846e+01
Coefficient B			9.08570e+02
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.			172.77
Temperature range, max.			376.07
η	0.0026699	Pa×s	172.77	Calculated Property
η	0.0014535	Pa×s	195.36	Calculated Property
η	0.0008976	Pa×s	217.95	Calculated Property
η	0.0006068	Pa×s	240.54	Calculated Property
η	0.0004388	Pa×s	263.13	Calculated Property
η	0.0003339	Pa×s	285.71	Calculated Property
η	0.0002645	Pa×s	308.30	Calculated Property
η	0.0002163	Pa×s	330.89	Calculated Property
η	0.0001815	Pa×s	353.48	Calculated Property
η	0.0001555	Pa×s	376.07	Calculated Property

Similar Compounds

Find more compounds similar to 1,3-Butadiene, 1-ethoxy-, (E).

Sources

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

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