Chemical Properties of 4-Hydroxy-nonadecanoic, .gamma.-lactone

InChI

InChI=1S/C19H36O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18-16-17-19(20)21-18/h18H,2-17H2,1H3

InChI Key

WTNURYXISAYHFJ-UHFFFAOYSA-N

Formula

C19H36O2

SMILES

CCCCCCCCCCCCCCCC1CCC(=O)O1

Molecular Weight¹

296.49

• 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).
• 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, 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	[401.44; 987.40]	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			-3.92160e+01
Coefficient B			1.90492e+00
Coefficient C			-1.13540e-03
Coefficient D			2.57100e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	401.44	J/mol×K	273.00	Calculated Property
Cp,gas	503.98	J/mol×K	353.78	Calculated Property
Cp,gas	595.27	J/mol×K	434.56	Calculated Property
Cp,gas	676.11	J/mol×K	515.33	Calculated Property
Cp,gas	747.33	J/mol×K	596.11	Calculated Property
Cp,gas	809.72	J/mol×K	676.89	Calculated Property
Cp,gas	864.12	J/mol×K	757.67	Calculated Property
Cp,gas	911.32	J/mol×K	838.44	Calculated Property
Cp,gas	952.14	J/mol×K	919.22	Calculated Property
Cp,gas	987.40	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0027202; 0.0003052]	Pa×s	[364.16; 610.68]	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			-1.13260e+01
Coefficient B			1.97336e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			364.16
Temperature range, max.			610.68
η	0.0027202	Pa×s	364.16	Calculated Property
η	0.0018620	Pa×s	391.55	Calculated Property
η	0.0013393	Pa×s	418.94	Calculated Property
η	0.0010030	Pa×s	446.33	Calculated Property
η	0.0007768	Pa×s	473.73	Calculated Property
η	0.0006186	Pa×s	501.12	Calculated Property
η	0.0005044	Pa×s	528.51	Calculated Property
η	0.0004196	Pa×s	555.90	Calculated Property
η	0.0003552	Pa×s	583.29	Calculated Property
η	0.0003052	Pa×s	610.68	Calculated Property

Similar Compounds

Find more compounds similar to 4-Hydroxy-nonadecanoic, .gamma.-lactone.

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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