Chemical Properties of (E)-2-Butene-d8 (CAS 1517-55-1)

InChI

InChI=1S/C4H8/c1-3-4-2/h3-4H,1-2H3/b4-3+/i1D3,2D3,3D,4D

InChI Key

IAQRGUVFOMOMEM-BDYLZKADSA-N

Formula

C4H8

SMILES

[2H]/C(=C(/[2H])C([2H])([2H])[2H])C([2H])([2H])[2H]

Molecular Weight¹

64.16

CAS

1517-55-1

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• IE : Ionization energy (eV).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, 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	[76.33; 195.11]	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			-1.49300e+01
Coefficient B			4.03840e-01
Coefficient C			-2.77600e-04
Coefficient D			8.38000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	76.33	J/mol×K	273.00	Calculated Property
Cp,gas	96.91	J/mol×K	353.78	Calculated Property
Cp,gas	115.02	J/mol×K	434.56	Calculated Property
Cp,gas	130.93	J/mol×K	515.33	Calculated Property
Cp,gas	144.91	J/mol×K	596.11	Calculated Property
Cp,gas	157.22	J/mol×K	676.89	Calculated Property
Cp,gas	168.14	J/mol×K	757.67	Calculated Property
Cp,gas	177.91	J/mol×K	838.44	Calculated Property
Cp,gas	186.81	J/mol×K	919.22	Calculated Property
Cp,gas	195.11	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0028777; 0.0001323]	Pa×s	[129.76; 326.43]	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			-1.09627e+01
Coefficient B			6.63320e+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.			129.76
Temperature range, max.			326.43
η	0.0028777	Pa×s	129.76	Calculated Property
η	0.0013774	Pa×s	151.61	Calculated Property
η	0.0007938	Pa×s	173.47	Calculated Property
η	0.0005175	Pa×s	195.32	Calculated Property
η	0.0003677	Pa×s	217.17	Calculated Property
η	0.0002781	Pa×s	239.02	Calculated Property
η	0.0002204	Pa×s	260.88	Calculated Property
η	0.0001811	Pa×s	282.73	Calculated Property
η	0.0001530	Pa×s	304.58	Calculated Property
η	0.0001323	Pa×s	326.43	Calculated Property

Similar Compounds

Find more compounds similar to (E)-2-Butene-d8.

Sources

• 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

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