Chemical Properties of 2-Propenenitrile, 3-chloro-2-methyl-

InChI

InChI=1S/C4H4ClN/c1-4(2-5)3-6/h2H,1H3/b4-2-

InChI Key

SRNADAWHRWZEFE-DUXPYHPUSA-N

Formula

C4H4ClN

SMILES

C/C(C#N)=C\Cl

Molecular Weight¹

101.54

Other Names

• 3-chloromethacrylonitrile

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• T_boil : Normal Boiling Point Temperature (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate 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, Ionization energy, 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	[91.27; 179.59]	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			1.52700e+01
Coefficient B			3.45320e-01
Coefficient C			-2.69300e-04
Coefficient D			8.83000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	91.27	J/mol×K	273.00	Calculated Property
Cp,gas	107.64	J/mol×K	353.78	Calculated Property
Cp,gas	121.72	J/mol×K	434.56	Calculated Property
Cp,gas	133.79	J/mol×K	515.33	Calculated Property
Cp,gas	144.13	J/mol×K	596.11	Calculated Property
Cp,gas	153.01	J/mol×K	676.89	Calculated Property
Cp,gas	160.72	J/mol×K	757.67	Calculated Property
Cp,gas	167.53	J/mol×K	838.44	Calculated Property
Cp,gas	173.73	J/mol×K	919.22	Calculated Property
Cp,gas	179.59	J/mol×K	1000.00	Calculated Property

Similar Compounds

Find more compounds similar to 2-Propenenitrile, 3-chloro-2-methyl-.

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

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Calculated This icon marks a calculated value or equation: a prediction, not a measurement.
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