Chemical Properties of Dicyclopentadiene, 3-methyl

InChI

InChI=1S/C11H14/c1-7-2-5-10-8-3-4-9(6-8)11(7)10/h2-4,8-11H,5-6H2,1H3

InChI Key

OGIBIEJZCZSNJK-UHFFFAOYSA-N

Formula

C11H14

SMILES

CC1=CCC2C3C=CC(C3)C12

Molecular Weight¹

146.23

• 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).
• I_np : Non-polar retention indices.
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfH°gas	163.96	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	19.68	kJ/mol	Joback Calculated Property
ΔvapH°	53.69	kJ/mol	Relay (1.0) Calculated Property
IE	8.24	eV	Relay (1.0) Calculated Property
logPoct/wat	2.775		Crippen Calculated Property
McVol	124.670	ml/mol	McGowan Calculated Property
Inp	[1084.00; 1084.00]
Inp	1084.00		NIST
Inp	1084.00		NIST

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	[155.48; 468.84]	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			-1.27160e+02
Coefficient B			1.29392e+00
Coefficient C			-1.04092e-03
Coefficient D			3.43000e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	155.48	J/mol×K	273.00	Calculated Property
Cp,gas	215.51	J/mol×K	353.78	Calculated Property
Cp,gas	266.70	J/mol×K	434.56	Calculated Property
Cp,gas	310.15	J/mol×K	515.33	Calculated Property
Cp,gas	346.93	J/mol×K	596.11	Calculated Property
Cp,gas	378.13	J/mol×K	676.89	Calculated Property
Cp,gas	404.84	J/mol×K	757.67	Calculated Property
Cp,gas	428.13	J/mol×K	838.44	Calculated Property
Cp,gas	449.11	J/mol×K	919.22	Calculated Property
Cp,gas	468.84	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0005705; 0.0012173]	Pa×s	[273.83; 483.59]	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			-5.72180e+00
Coefficient B			-4.78420e+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.			273.83
Temperature range, max.			483.59
η	0.0005705	Pa×s	273.83	Calculated Property
η	0.0006543	Pa×s	297.14	Calculated Property
η	0.0007356	Pa×s	320.44	Calculated Property
η	0.0008140	Pa×s	343.75	Calculated Property
η	0.0008892	Pa×s	367.06	Calculated Property
η	0.0009611	Pa×s	390.36	Calculated Property
η	0.0010299	Pa×s	413.67	Calculated Property
η	0.0010954	Pa×s	436.97	Calculated Property
η	0.0011578	Pa×s	460.28	Calculated Property
η	0.0012173	Pa×s	483.59	Calculated Property

Similar Compounds

Find more compounds similar to Dicyclopentadiene, 3-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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