Chemical Properties of Linalool oxide, dihydro

InChI

InChI=1S/C10H20O2/c1-5-10(4)7-6-8(12-10)9(2,3)11/h8,11H,5-7H2,1-4H3

InChI Key

ZSIHHIBGUWREKL-UHFFFAOYSA-N

Formula

C10H20O2

SMILES

CCC1(C)CCC(C(C)(C)O)O1

Molecular Weight¹

172.26

• 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).
• I_np : Non-polar retention indices.
• 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	[211.13; 572.18]	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			-1.12599e+02
Coefficient B			1.50778e+00
Coefficient C			-1.31310e-03
Coefficient D			4.90100e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	211.13	J/mol×K	273.00	Calculated Property
Cp,gas	278.17	J/mol×K	353.78	Calculated Property
Cp,gas	334.87	J/mol×K	434.56	Calculated Property
Cp,gas	382.77	J/mol×K	515.33	Calculated Property
Cp,gas	423.41	J/mol×K	596.11	Calculated Property
Cp,gas	458.36	J/mol×K	676.89	Calculated Property
Cp,gas	489.17	J/mol×K	757.67	Calculated Property
Cp,gas	517.37	J/mol×K	838.44	Calculated Property
Cp,gas	544.52	J/mol×K	919.22	Calculated Property
Cp,gas	572.18	J/mol×K	1000.00	Calculated Property

Similar Compounds

Find more compounds similar to Linalool oxide, dihydro.

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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