Chemical Properties of 5-methyl-N-isobutyl 3-pyrroline

InChI

InChI=1S/C9H17N/c1-8(2)7-10-6-4-5-9(10)3/h4-5,8-9H,6-7H2,1-3H3

InChI Key

AQGPGTSPNDCWCK-UHFFFAOYSA-N

Formula

C9H17N

SMILES

CC(C)CN1CC=CC1C

Molecular Weight¹

139.24

• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I : Polar retention indices.
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
log10WS	-1.78		Crippen Calculated Property
logPoct/wat	1.903		Crippen Calculated Property
McVol	132.490	ml/mol	McGowan Calculated Property
I	[1237.00; 1237.00]
I	1237.00		NIST
I	1237.00		NIST

Similar Compounds

Find more compounds similar to 5-methyl-N-isobutyl 3-pyrroline.

Sources

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

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