Chemical Properties of 1-Cyclopropanecarboxamide, 2-phenyl-N-isobutyl-

InChI

InChI=1S/C14H19NO/c1-10(2)9-15-14(16)13-8-12(13)11-6-4-3-5-7-11/h3-7,10,12-13H,8-9H2,1-2H3,(H,15,16)

InChI Key

ZTMXNWWGYHNZLM-UHFFFAOYSA-N

Formula

C14H19NO

SMILES

CC(C)CN=C(O)C1CC1c1ccccc1

Molecular Weight¹

217.31

• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
logPoct/wat	3.403		Crippen Calculated Property
McVol	185.050	ml/mol	McGowan Calculated Property
Inp	[2053.00; 2053.00]
Inp	2053.00		NIST
Inp	2053.00		NIST
Tboil	591.04	K	Relay (1.0) Calculated Property

Cheméo can also estimate Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Similar Compounds

Find more compounds similar to 1-Cyclopropanecarboxamide, 2-phenyl-N-isobutyl-.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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