Chemical Properties of Pentanedioic acid, 2-octanoylamino, dimethyl ester

InChI

InChI=1S/C15H27NO5/c1-4-5-6-7-8-9-13(17)16-12(15(19)21-3)10-11-14(18)20-2/h12H,4-11H2,1-3H3,(H,16,17)

InChI Key

GKNLUTKJUBKURO-UHFFFAOYSA-N

Formula

C15H27NO5

SMILES

CCCCCCCC(O)=NC(CCC(=O)OC)C(=O)OC

Molecular Weight¹

301.38

• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• 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).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfH°gas	-927.61	kJ/mol	Joback Calculated Property
ΔvapH°	86.98	kJ/mol	Joback Calculated Property
log10WS	-2.92		Crippen Calculated Property
logPoct/wat	2.798		Crippen Calculated Property
McVol	248.640	ml/mol	McGowan Calculated Property
Pc	1518.75	kPa	Joback Calculated Property
Inp	[2031.00; 2031.00]
Inp	2031.00		NIST
Inp	2031.00		NIST
Tboil	863.48	K	Joback Calculated Property
Tc	1060.61	K	Joback Calculated Property

Similar Compounds

Find more compounds similar to Pentanedioic acid, 2-octanoylamino, dimethyl ester.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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