Chemical Properties of Vinyl crotonate (CAS 14861-06-4)

InChI

InChI=1S/C6H8O2/c1-3-5-6(7)8-4-2/h3-5H,2H2,1H3/b5-3+

InChI Key

IYNRVIKPUTZSOR-HWKANZROSA-N

Formula

C6H8O2

SMILES

C=COC(=O)C=CC

Molecular Weight¹

112.13

CAS

14861-06-4

Other Names

• Crotonic acid vinyl ester
• 2-Butenoic acid, ethenyl ester
• Vinyl 2-butenoate
• Vinylester kyseliny krotonove

• 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).
• 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).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Standard Gibbs free energy of formation, Log10 of Water solubility in mol/l 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	[125.29; 277.89]	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			5.67000e+00
Coefficient B			5.19020e-01
Coefficient C			-3.14700e-04
Coefficient D			6.79000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	125.29	J/mol×K	273.00	Calculated Property
Cp,gas	152.91	J/mol×K	353.78	Calculated Property
Cp,gas	177.36	J/mol×K	434.56	Calculated Property
Cp,gas	198.86	J/mol×K	515.33	Calculated Property
Cp,gas	217.62	J/mol×K	596.11	Calculated Property
Cp,gas	233.86	J/mol×K	676.89	Calculated Property
Cp,gas	247.79	J/mol×K	757.67	Calculated Property
Cp,gas	259.63	J/mol×K	838.44	Calculated Property
Cp,gas	269.59	J/mol×K	919.22	Calculated Property
Cp,gas	277.89	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0048250; 0.0001939]	Pa×s	[192.87; 407.77]	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			-1.14324e+01
Coefficient B			1.17620e+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.			192.87
Temperature range, max.			407.77
η	0.0048250	Pa×s	192.87	Calculated Property
η	0.0024644	Pa×s	216.75	Calculated Property
η	0.0014383	Pa×s	240.63	Calculated Property
η	0.0009251	Pa×s	264.50	Calculated Property
η	0.0006402	Pa×s	288.38	Calculated Property
η	0.0004687	Pa×s	312.26	Calculated Property
η	0.0003586	Pa×s	336.14	Calculated Property
η	0.0002844	Pa×s	360.02	Calculated Property
η	0.0002321	Pa×s	383.90	Calculated Property
η	0.0001939	Pa×s	407.77	Calculated Property

Similar Compounds

Find more compounds similar to Vinyl crotonate.

Sources

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

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