Chemical Properties of 13-methyltetradecanoic acid (CAS 50973-09-6)

InChI

InChI=1S/C15H30O2/c1-14(2)12-10-8-6-4-3-5-7-9-11-13-15(16)17/h14H,3-13H2,1-2H3,(H,16,17)

InChI Key

ZOCYQVNGROEVLU-UHFFFAOYSA-N

Formula

C15H30O2

SMILES

CC(C)CCCCCCCCCCCC(=O)O

Molecular Weight¹

242.40

CAS

50973-09-6

• 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).
• P_vap : Vapor pressure (kPa).
• I : Polar retention indices.
• 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

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[666.72; 754.33]	J/mol×K	[687.87; 866.30]
Cp,gas	666.72	J/mol×K	687.87	Joback Calculated Property
Cp,gas	683.21	J/mol×K	717.61	Joback Calculated Property
Cp,gas	698.89	J/mol×K	747.35	Joback Calculated Property
Cp,gas	713.82	J/mol×K	777.08	Joback Calculated Property
Cp,gas	728.01	J/mol×K	806.82	Joback Calculated Property
Cp,gas	741.51	J/mol×K	836.56	Joback Calculated Property
Cp,gas	754.33	J/mol×K	866.30	Joback Calculated Property
η	[0.0001172; 0.0015425]	Pa×s	[404.41; 687.87]
η	0.0015425	Pa×s	404.41	Joback Calculated Property
η	0.0008018	Pa×s	451.65	Joback Calculated Property
η	0.0004718	Pa×s	498.90	Joback Calculated Property
η	0.0003043	Pa×s	546.14	Joback Calculated Property
η	0.0002104	Pa×s	593.38	Joback Calculated Property
η	0.0001537	Pa×s	640.63	Joback Calculated Property
η	0.0001172	Pa×s	687.87	Joback Calculated Property

Correlations

Property	Value	Unit	Temperature (K)	Source
Pvap	[1.33; 202.64]	kPa	[470.52; 638.98]	The Yaws Handbook of Vapor Pressure
Equation			ln(Pvp) = A + B/(T + C)
Coefficient A			1.60357e+01
Coefficient B			-5.66316e+03
Coefficient C			-1.10911e+02
Temperature range, min.			470.52
Temperature range, max.			638.98
Pvap	1.33	kPa	470.52	Calculated Property
Pvap	2.91	kPa	489.24	Calculated Property
Pvap	5.88	kPa	507.96	Calculated Property
Pvap	11.18	kPa	526.67	Calculated Property
Pvap	20.11	kPa	545.39	Calculated Property
Pvap	34.46	kPa	564.11	Calculated Property
Pvap	56.56	kPa	582.83	Calculated Property
Pvap	89.40	kPa	601.54	Calculated Property
Pvap	136.63	kPa	620.26	Calculated Property
Pvap	202.64	kPa	638.98	Calculated Property

Similar Compounds

Find more compounds similar to 13-methyltetradecanoic acid.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook
• The Yaws Handbook of Vapor Pressure

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