Chemical Properties of Valeric acid, tridecyl ester (CAS 117177-34-1)

InChI

InChI=1S/C18H36O2/c1-3-5-7-8-9-10-11-12-13-14-15-17-20-18(19)16-6-4-2/h3-17H2,1-2H3

InChI Key

KGUAWIPVMCVZCA-UHFFFAOYSA-N

Formula

C18H36O2

SMILES

CCCCCCCCCCCCCOC(=O)CCCC

Molecular Weight¹

284.48

CAS

117177-34-1

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• 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).
• P_c : Critical Pressure (kPa).
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[403.67; 956.08]	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			1.19350e+01
Coefficient B			1.65904e+00
Coefficient C			-8.60800e-04
Coefficient D			1.45900e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	403.67	J/mol×K	273.00	Calculated Property
Cp,gas	497.59	J/mol×K	353.78	Calculated Property
Cp,gas	582.30	J/mol×K	434.56	Calculated Property
Cp,gas	658.26	J/mol×K	515.33	Calculated Property
Cp,gas	725.93	J/mol×K	596.11	Calculated Property
Cp,gas	785.77	J/mol×K	676.89	Calculated Property
Cp,gas	838.24	J/mol×K	757.67	Calculated Property
Cp,gas	883.81	J/mol×K	838.44	Calculated Property
Cp,gas	922.93	J/mol×K	919.22	Calculated Property
Cp,gas	956.07	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0030583; 0.0001443]	Pa×s	[334.95; 584.67]	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			-1.29403e+01
Coefficient B			2.39504e+03
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.			334.95
Temperature range, max.			584.67
η	0.0030583	Pa×s	334.95	Calculated Property
η	0.0017698	Pa×s	362.70	Calculated Property
η	0.0011069	Pa×s	390.44	Calculated Property
η	0.0007368	Pa×s	418.19	Calculated Property
η	0.0005159	Pa×s	445.94	Calculated Property
η	0.0003767	Pa×s	473.68	Calculated Property
η	0.0002847	Pa×s	501.43	Calculated Property
η	0.0002217	Pa×s	529.18	Calculated Property
η	0.0001769	Pa×s	556.93	Calculated Property
η	0.0001443	Pa×s	584.67	Calculated Property

Similar Compounds

Find more compounds similar to Valeric acid, tridecyl ester.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
Calculated This icon marks a calculated value or equation: a prediction, not a measurement.
These property values are available through the Cheméo API. A free account gives you an access key.