Chemical Properties of 10-Undecenoic acid, 4,4-dimethyloxazoline derivative

InChI

InChI=1S/C15H27NO/c1-4-5-6-7-8-9-10-11-12-14-16-15(2,3)13-17-14/h4H,1,5-13H2,2-3H3

InChI Key

WMCSKOUEEYZGDK-UHFFFAOYSA-N

Formula

C15H27NO

SMILES

C=CCCCCCCCCC1=NC(C)(C)CO1

Molecular Weight¹

237.38

Other Names

• 10-Undecenoic acid, DMOX derivative
• 10-Undecenoic acid, 4,4-Dimethyloxazoline (DMOX) derivative

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• 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).
• I_np : Non-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	0.6258		Relay (1.0) Calculated Property
ΔfG°	245.31	kJ/mol	Joback Calculated Property
ΔfH°gas	-311.13	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	34.91	kJ/mol	Joback Calculated Property
ΔvapH°	72.41	kJ/mol	Relay (1.0) Calculated Property
IE	8.61	eV	Relay (1.0) Calculated Property
log10WS	-4.16		Relay (1.0) Calculated Property
logPoct/wat	4.500		Crippen Calculated Property
McVol	218.600	ml/mol	McGowan Calculated Property
Pc	1768.38	kPa	Joback Calculated Property
Inp	[1614.50; 1614.50]
Inp	1614.50		NIST
Inp	1614.50		NIST
Tboil	560.03	K	Relay (1.0) Calculated Property
Tc	758.88	K	Relay (1.0) Calculated Property
Tfus	266.96	K	Relay (1.0) Calculated Property
Vc	0.818	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[618.38; 723.43]	J/mol×K	[639.59; 838.33]
Cp,gas	618.38	J/mol×K	639.59	Joback Calculated Property
Cp,gas	637.96	J/mol×K	672.71	Joback Calculated Property
Cp,gas	656.59	J/mol×K	705.84	Joback Calculated Property
Cp,gas	674.35	J/mol×K	738.96	Joback Calculated Property
Cp,gas	691.35	J/mol×K	772.08	Joback Calculated Property
Cp,gas	707.68	J/mol×K	805.20	Joback Calculated Property
Cp,gas	723.43	J/mol×K	838.33	Joback Calculated Property

Similar Compounds

Find more compounds similar to 10-Undecenoic acid, 4,4-dimethyloxazoline derivative.

Sources

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

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