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

InChI

InChI=1S/C10H17NO3/c1-4-9(12)11-6-5-10(13)14-7-8(2)3/h4,8H,1,5-7H2,2-3H3,(H,11,12)

InChI Key

AJCDVZHADBTWCQ-UHFFFAOYSA-N

Formula

C10H17NO3

SMILES

C=CC(O)=NCCC(=O)OCC(C)C

Molecular Weight¹

199.25

• 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	-454.18	kJ/mol	Joback Calculated Property
ΔvapH°	66.03	kJ/mol	Joback Calculated Property
log10WS	-1.47		Crippen Calculated Property
logPoct/wat	1.718		Crippen Calculated Property
McVol	166.450	ml/mol	McGowan Calculated Property
Pc	2289.32	kPa	Joback Calculated Property
Inp	[1541.00; 1541.00]
Inp	1541.00		NIST
Inp	1541.00		NIST
Tboil	669.47	K	Joback Calculated Property
Tc	857.90	K	Joback Calculated Property

Similar Compounds

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

Sources

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

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