Chemical Properties of Isomyocorene (CAS 6876-07-9)

InChI

InChI=1S/C10H16/c1-5-10(4)8-6-7-9(2)3/h5-7,10H,1-2,8H2,3-4H3/b7-6+

InChI Key

JWMIAIJDECOUIA-VOTSOKGWSA-N

Formula

C10H16

SMILES

C=CC(C)CC=CC(=C)C

Molecular Weight¹

136.23

CAS

6876-07-9

Other Names

• 2,6-Dimethyl 1,3,7-octatriene (alpha menthrene)

• 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	[183.84; 447.90]	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			-2.77390e+01
Coefficient B			9.39640e-01
Coefficient C			-6.55300e-04
Coefficient D			1.91300e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	183.84	J/mol×K	273.00	Calculated Property
Cp,gas	231.14	J/mol×K	353.78	Calculated Property
Cp,gas	272.54	J/mol×K	434.56	Calculated Property
Cp,gas	308.64	J/mol×K	515.33	Calculated Property
Cp,gas	340.05	J/mol×K	596.11	Calculated Property
Cp,gas	367.38	J/mol×K	676.89	Calculated Property
Cp,gas	391.22	J/mol×K	757.67	Calculated Property
Cp,gas	412.18	J/mol×K	838.44	Calculated Property
Cp,gas	430.88	J/mol×K	919.22	Calculated Property
Cp,gas	447.90	J/mol×K	1000.00	Calculated Property

Similar Compounds

Find more compounds similar to Isomyocorene.

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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