Chemical Properties of Isobutylcarbamate, N-benzyl

InChI

InChI=1S/C12H17NO2/c1-10(2)9-15-12(14)13-8-11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3,(H,13,14)

InChI Key

LTJFRJHNUIOOST-UHFFFAOYSA-N

Formula

C12H17NO2

SMILES

CC(C)COC(O)=NCc1ccccc1

Molecular Weight¹

207.27

• 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	-271.78	kJ/mol	Joback Calculated Property
ΔvapH°	66.68	kJ/mol	Joback Calculated Property
log10WS	-2.77		Crippen Calculated Property
logPoct/wat	2.773		Crippen Calculated Property
McVol	173.600	ml/mol	McGowan Calculated Property
Pc	2365.67	kPa	Joback Calculated Property
Inp	[1649.00; 1649.00]
Inp	1649.00		NIST
Inp	1649.00		NIST
Tboil	691.36	K	Joback Calculated Property
Tc	898.05	K	Joback Calculated Property

Similar Compounds

Find more compounds similar to Isobutylcarbamate, N-benzyl.

Sources

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

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