Chemical Properties of 2-Oxecanone, 10-methyl-, (.+-.)-

InChI

InChI=1S/C10H18O2/c1-9-7-5-3-2-4-6-8-10(11)12-9/h9H,2-8H2,1H3

InChI Key

SAMJSVOFANTIOD-UHFFFAOYSA-N

Formula

C10H18O2

SMILES

CC1CCCCCCCC(=O)O1

Molecular Weight¹

170.25

Other Names

• (.+/-.)-Decan-9-olide
• (.+/-.)-Phoracantholide I
• 9-Decanolide
• 10-Methyl-2-oxecanone

• 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).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I_np : Non-polar retention indices.
• 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, Standard Gibbs free energy of formation, Acentric Factor 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	[186.05; 531.98]	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			-5.66400e+01
Coefficient B			1.00192e+00
Coefficient C			-4.13800e-04
Coefficient D			5.00000e-10
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	186.05	J/mol×K	273.00	Calculated Property
Cp,gas	246.05	J/mol×K	353.78	Calculated Property
Cp,gas	300.65	J/mol×K	434.56	Calculated Property
Cp,gas	349.86	J/mol×K	515.33	Calculated Property
Cp,gas	393.68	J/mol×K	596.11	Calculated Property
Cp,gas	432.11	J/mol×K	676.89	Calculated Property
Cp,gas	465.15	J/mol×K	757.67	Calculated Property
Cp,gas	492.81	J/mol×K	838.44	Calculated Property
Cp,gas	515.09	J/mol×K	919.22	Calculated Property
Cp,gas	531.98	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0159326; 0.0001493]	Pa×s	[245.13; 512.88]	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			-1.30847e+01
Coefficient B			2.19277e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			245.13
Temperature range, max.			512.88
η	0.0159326	Pa×s	245.13	Calculated Property
η	0.0060510	Pa×s	274.88	Calculated Property
η	0.0027764	Pa×s	304.63	Calculated Property
η	0.0014634	Pa×s	334.38	Calculated Property
η	0.0008564	Pa×s	364.13	Calculated Property
η	0.0005434	Pa×s	393.88	Calculated Property
η	0.0003676	Pa×s	423.63	Calculated Property
η	0.0002617	Pa×s	453.38	Calculated Property
η	0.0001943	Pa×s	483.13	Calculated Property
η	0.0001493	Pa×s	512.88	Calculated Property

Similar Compounds

Find more compounds similar to 2-Oxecanone, 10-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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