Chemical Properties of «beta»-Alanine, N-acryloyl-, hexadecyl ester

InChI

InChI=1S/C22H41NO3/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-20-26-22(25)18-19-23-21(24)4-2/h4H,2-3,5-20H2,1H3,(H,23,24)

InChI Key

WIOZKABCIJIXOA-UHFFFAOYSA-N

Formula

C22H41NO3

SMILES

C=CC(O)=NCCC(=O)OCCCCCCCCCCCCCCCC

Molecular Weight¹

367.57

• 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	-696.58	kJ/mol	Joback Calculated Property
ΔvapH°	93.12	kJ/mol	Joback Calculated Property
log10WS	-6.73		Crippen Calculated Property
logPoct/wat	6.543		Crippen Calculated Property
McVol	335.530	ml/mol	McGowan Calculated Property
Pc	946.75	kPa	Joback Calculated Property
Inp	[2825.00; 2825.00]
Inp	2825.00		NIST
Inp	2825.00		NIST
Tboil	944.47	K	Joback Calculated Property
Tc	1158.94	K	Joback Calculated Property

Similar Compounds

Find more compounds similar to «beta»-Alanine, N-acryloyl-, hexadecyl ester.

Sources

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

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