Chemical Properties of Tricyclo[4.2.2.2(2,5)]dodec-3-ene

InChI

InChI=1S/C12H18/c1-2-10-4-3-9(1)11-5-7-12(10)8-6-11/h1-2,9-12H,3-8H2

InChI Key

HEGVALGWBKKXHA-UHFFFAOYSA-N

Formula

C12H18

SMILES

C1=CC2CCC1C1CCC2CC1

Molecular Weight¹

162.28

• 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).
• IE : Ionization energy (eV).
• 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, 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	[170.83; 558.33]	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			-1.60390e+02
Coefficient B			1.48520e+00
Coefficient C			-1.08228e-03
Coefficient D			3.15800e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	170.83	J/mol×K	273.00	Calculated Property
Cp,gas	243.57	J/mol×K	353.78	Calculated Property
Cp,gas	306.55	J/mol×K	434.56	Calculated Property
Cp,gas	360.78	J/mol×K	515.33	Calculated Property
Cp,gas	407.26	J/mol×K	596.11	Calculated Property
Cp,gas	446.99	J/mol×K	676.89	Calculated Property
Cp,gas	480.96	J/mol×K	757.67	Calculated Property
Cp,gas	510.17	J/mol×K	838.44	Calculated Property
Cp,gas	535.63	J/mol×K	919.22	Calculated Property
Cp,gas	558.33	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0013809; 0.0009791]	Pa×s	[264.78; 509.58]	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			-7.30070e+00
Coefficient B			1.89500e+02
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			264.78
Temperature range, max.			509.58
η	0.0013809	Pa×s	264.78	Calculated Property
η	0.0012918	Pa×s	291.98	Calculated Property
η	0.0012223	Pa×s	319.18	Calculated Property
η	0.0011667	Pa×s	346.38	Calculated Property
η	0.0011211	Pa×s	373.58	Calculated Property
η	0.0010832	Pa×s	400.78	Calculated Property
η	0.0010511	Pa×s	427.98	Calculated Property
η	0.0010236	Pa×s	455.18	Calculated Property
η	0.0009999	Pa×s	482.38	Calculated Property
η	0.0009791	Pa×s	509.58	Calculated Property

Similar Compounds

Find more compounds similar to Tricyclo[4.2.2.2(2,5)]dodec-3-ene.

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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