Chemical Properties of Undecanoic acid, 10-methyl-, methyl ester

InChI

InChI=1S/C13H26O2/c1-12(2)10-8-6-4-5-7-9-11-13(14)15-3/h12H,4-11H2,1-3H3

InChI Key

XPVCTJYIICVJOE-UHFFFAOYSA-N

Formula

C13H26O2

SMILES

COC(=O)CCCCCCCCC(C)C

Molecular Weight¹

214.35

Other Names

• Methyl 10-methylundecanoate
• Methyl isododecanoate (iso-12:0)

• 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	[297.28; 698.66]	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			1.47980e+01
Coefficient B			1.18996e+00
Coefficient C			-5.92000e-04
Coefficient D			8.59000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	297.28	J/mol×K	273.00	Calculated Property
Cp,gas	365.49	J/mol×K	353.78	Calculated Property
Cp,gas	427.16	J/mol×K	434.56	Calculated Property
Cp,gas	482.56	J/mol×K	515.33	Calculated Property
Cp,gas	531.98	J/mol×K	596.11	Calculated Property
Cp,gas	575.67	J/mol×K	676.89	Calculated Property
Cp,gas	613.91	J/mol×K	757.67	Calculated Property
Cp,gas	646.97	J/mol×K	838.44	Calculated Property
Cp,gas	675.13	J/mol×K	919.22	Calculated Property
Cp,gas	698.66	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0073059; 0.0002054]	Pa×s	[263.60; 506.75]	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			-1.23624e+01
Coefficient B			1.96206e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			263.60
Temperature range, max.			506.75
η	0.0073059	Pa×s	263.60	Calculated Property
η	0.0036573	Pa×s	290.62	Calculated Property
η	0.0020596	Pa×s	317.63	Calculated Property
η	0.0012691	Pa×s	344.65	Calculated Property
η	0.0008390	Pa×s	371.67	Calculated Property
η	0.0005867	Pa×s	398.68	Calculated Property
η	0.0004293	Pa×s	425.70	Calculated Property
η	0.0003261	Pa×s	452.71	Calculated Property
η	0.0002555	Pa×s	479.73	Calculated Property
η	0.0002054	Pa×s	506.75	Calculated Property

Similar Compounds

Find more compounds similar to Undecanoic acid, 10-methyl-, methyl ester.

Sources

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

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