Chemical Properties of Methyl 10-hydroxyundecanoate

InChI

InChI=1S/C12H24O3/c1-11(13)9-7-5-3-4-6-8-10-12(14)15-2/h11,13H,3-10H2,1-2H3

InChI Key

UFIVBIIQLDEBCZ-UHFFFAOYSA-N

Formula

C12H24O3

SMILES

COC(=O)CCCCCCCCC(C)O

Molecular Weight¹

216.32

• ω : Acentric Factor.
• 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).
• P_c : Critical Pressure (kPa).
• I_np : Non-polar retention indices.
• 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

Property	Value	Unit	Source
ω	0.8474		Relay (1.0) Calculated Property
ΔfH°gas	-782.81	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	31.77	kJ/mol	Joback Calculated Property
ΔvapH°	96.40	kJ/mol	Relay (1.0) Calculated Property
IE	9.73	eV	Relay (1.0) Calculated Property
log10WS	-2.40		Relay (1.0) Calculated Property
logPoct/wat	2.661		Crippen Calculated Property
McVol	193.250	ml/mol	McGowan Calculated Property
Pc	1949.23	kPa	Joback Calculated Property
Inp	[1592.00; 1592.00]
Inp	1592.00		NIST
Inp	1592.00		NIST
I	[2220.00; 2220.00]
I	2220.00		NIST
I	2220.00		NIST
Tboil	549.41	K	Relay (1.0) Calculated Property
Tc	727.96	K	Relay (1.0) Calculated Property
Tfus	304.21	K	Relay (1.0) Calculated Property
Vc	0.744	m3/kmol	Relay (1.0) Calculated Property

Cheméo can also estimate Standard Gibbs free energy of formation for this compound, but it falls outside the models' validated range, so it is not shown here. Open the prediction tool to compute it on demand.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[524.71; 599.80]	J/mol×K	[624.12; 790.28]
Cp,gas	524.71	J/mol×K	624.12	Joback Calculated Property
Cp,gas	538.74	J/mol×K	651.81	Joback Calculated Property
Cp,gas	552.15	J/mol×K	679.51	Joback Calculated Property
Cp,gas	564.95	J/mol×K	707.20	Joback Calculated Property
Cp,gas	577.15	J/mol×K	734.89	Joback Calculated Property
Cp,gas	588.76	J/mol×K	762.59	Joback Calculated Property
Cp,gas	599.80	J/mol×K	790.28	Joback Calculated Property
η	[0.0000481; 0.0144784]	Pa×s	[313.15; 624.12]
η	0.0144784	Pa×s	313.15	Joback Calculated Property
η	0.0028458	Pa×s	364.98	Joback Calculated Property
η	0.0008383	Pa×s	416.81	Joback Calculated Property
η	0.0003236	Pa×s	468.63	Joback Calculated Property
η	0.0001510	Pa×s	520.46	Joback Calculated Property
η	0.0000809	Pa×s	572.29	Joback Calculated Property
η	0.0000481	Pa×s	624.12	Joback Calculated Property

Similar Compounds

Find more compounds similar to Methyl 10-hydroxyundecanoate.

Sources

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

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