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

InChI

InChI=1S/C21H39NO3/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-19-25-21(24)17-18-22-20(23)4-2/h4H,2-3,5-19H2,1H3,(H,22,23)

InChI Key

HBJUVECDQNKNDL-UHFFFAOYSA-N

Formula

C21H39NO3

SMILES

C=CC(O)=NCCC(=O)OCCCCCCCCCCCCCCC

Molecular Weight¹

353.54

• 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	-675.94	kJ/mol	Joback Calculated Property
ΔvapH°	90.90	kJ/mol	Joback Calculated Property
log10WS	-6.31		Crippen Calculated Property
logPoct/wat	6.153		Crippen Calculated Property
McVol	321.440	ml/mol	McGowan Calculated Property
Pc	1005.26	kPa	Joback Calculated Property
Inp	[2717.00; 2717.00]
Inp	2717.00		NIST
Inp	2717.00		NIST
Tboil	921.59	K	Joback Calculated Property
Tc	1129.10	K	Joback Calculated Property

Similar Compounds

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

Sources

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

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