Chemical Properties of 2-Butenedioic acid (E)-, di-2-propenyl ester (CAS 2807-54-7)

InChI

InChI=1S/C10H12O4/c1-3-7-13-9(11)5-6-10(12)14-8-4-2/h3-6H,1-2,7-8H2/b6-5+

InChI Key

ZPOLOEWJWXZUSP-AATRIKPKSA-N

Formula

C10H12O4

SMILES

C=CCOC(=O)C=CC(=O)OCC=C

Molecular Weight¹

196.20

CAS

2807-54-7

Other Names

• Diallyl fumarate
• Fumaric acid, diallyl ester

• 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).
• T_boil : Normal Boiling Point 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 Temperature, Critical Pressure, 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	[216.67; 463.85]	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			2.44520e+01
Coefficient B			8.24200e-01
Coefficient C			-4.60600e-04
Coefficient D			7.58000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	216.67	J/mol×K	273.00	Calculated Property
Cp,gas	261.74	J/mol×K	353.78	Calculated Property
Cp,gas	301.85	J/mol×K	434.56	Calculated Property
Cp,gas	337.24	J/mol×K	515.33	Calculated Property
Cp,gas	368.15	J/mol×K	596.11	Calculated Property
Cp,gas	394.82	J/mol×K	676.89	Calculated Property
Cp,gas	417.48	J/mol×K	757.67	Calculated Property
Cp,gas	436.38	J/mol×K	838.44	Calculated Property
Cp,gas	451.76	J/mol×K	919.22	Calculated Property
Cp,gas	463.85	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0038556; 0.0001783]	Pa×s	[278.52; 511.96]	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			-1.22989e+01
Coefficient B			1.87740e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			278.52
Temperature range, max.			511.96
η	0.0038556	Pa×s	278.52	Calculated Property
η	0.0021712	Pa×s	304.46	Calculated Property
η	0.0013380	Pa×s	330.40	Calculated Property
η	0.0008848	Pa×s	356.33	Calculated Property
η	0.0006188	Pa×s	382.27	Calculated Property
η	0.0004529	Pa×s	408.21	Calculated Property
η	0.0003441	Pa×s	434.15	Calculated Property
η	0.0002697	Pa×s	460.08	Calculated Property
η	0.0002169	Pa×s	486.02	Calculated Property
η	0.0001783	Pa×s	511.96	Calculated Property

Similar Compounds

Find more compounds similar to 2-Butenedioic acid (E)-, di-2-propenyl ester.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
These property values are available through the Cheméo API. A free account gives you an access key.