Chemical Properties of Anti-tricyclo[3.2.0.0(2,4)]hept-6-ene (CAS 79356-83-5)

InChI

InChI=1S/C7H8/c1-2-5-4(1)6-3-7(5)6/h1-2,4-7H,3H2

InChI Key

DLJZNMLNAZRUHZ-UHFFFAOYSA-N

Formula

C7H8

SMILES

C1=CC2C1C1CC21

Molecular Weight¹

92.14

CAS

79356-83-5

• 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).
• 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, 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	[89.23; 291.48]	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			-1.30240e+02
Coefficient B			1.05820e+00
Coefficient C			-1.04228e-03
Coefficient D			4.05800e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	89.23	J/mol×K	273.00	Calculated Property
Cp,gas	131.65	J/mol×K	353.78	Calculated Property
Cp,gas	166.08	J/mol×K	434.56	Calculated Property
Cp,gas	193.83	J/mol×K	515.33	Calculated Property
Cp,gas	216.15	J/mol×K	596.11	Calculated Property
Cp,gas	234.35	J/mol×K	676.89	Calculated Property
Cp,gas	249.69	J/mol×K	757.67	Calculated Property
Cp,gas	263.48	J/mol×K	838.44	Calculated Property
Cp,gas	276.98	J/mol×K	919.22	Calculated Property
Cp,gas	291.48	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0000532; 0.0006738]	Pa×s	[226.03; 393.53]	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			-3.87668e+00
Coefficient B			-1.34815e+03
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.			226.03
Temperature range, max.			393.53
η	0.0000532	Pa×s	226.03	Calculated Property
η	0.0000838	Pa×s	244.64	Calculated Property
η	0.0001237	Pa×s	263.25	Calculated Property
η	0.0001734	Pa×s	281.86	Calculated Property
η	0.0002332	Pa×s	300.47	Calculated Property
η	0.0003030	Pa×s	319.08	Calculated Property
η	0.0003825	Pa×s	337.69	Calculated Property
η	0.0004711	Pa×s	356.30	Calculated Property
η	0.0005685	Pa×s	374.92	Calculated Property
η	0.0006738	Pa×s	393.53	Calculated Property

Similar Compounds

Find more compounds similar to Anti-tricyclo[3.2.0.0(2,4)]hept-6-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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