Chemical Properties of 1,1,2,2-Cyclopropane-tetracarbonitrile (CAS 2424-32-0)

InChI

InChI=1S/C7H2N4/c8-2-6(3-9)1-7(6,4-10)5-11/h1H2

InChI Key

PSDKLXIWEMMSLZ-UHFFFAOYSA-N

Formula

C7H2N4

SMILES

N#CC1(C#N)CC1(C#N)C#N

Molecular Weight¹

142.12

CAS

2424-32-0

Other Names

• 1,1,2,2-Tetracyanocyclopropane

• Δ_cH°_solid : Standard solid enthalpy of combustion (kJ/mol).
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fH°_solid : Solid phase enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• 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, 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	[130.45; 287.44]	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			-7.97600e+01
Coefficient B			1.11620e+00
Coefficient C			-1.46300e-03
Coefficient D			7.14000e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	130.45	J/mol×K	273.00	Calculated Property
Cp,gas	163.63	J/mol×K	353.78	Calculated Property
Cp,gas	187.61	J/mol×K	434.56	Calculated Property
Cp,gas	204.64	J/mol×K	515.33	Calculated Property
Cp,gas	216.99	J/mol×K	596.11	Calculated Property
Cp,gas	226.91	J/mol×K	676.89	Calculated Property
Cp,gas	236.65	J/mol×K	757.67	Calculated Property
Cp,gas	248.48	J/mol×K	838.44	Calculated Property
Cp,gas	264.66	J/mol×K	919.22	Calculated Property
Cp,gas	287.44	J/mol×K	1000.00	Calculated Property

Similar Compounds

Find more compounds similar to 1,1,2,2-Cyclopropane-tetracarbonitrile.

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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