Chemical Properties of Lycoramine (CAS 21133-52-8)

InChI

InChI=1S/C17H23NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-4,12,14,19H,5-10H2,1-2H3

InChI Key

GJRMHIXYLGOZSE-UHFFFAOYSA-N

Formula

C17H23NO3

SMILES

COc1ccc2c3c1OC1CC(O)CCC31CCN(C)C2

Molecular Weight¹

289.37

CAS

21133-52-8

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

Physical Properties

Property	Value	Unit	Source
log10WS	-3.32		Crippen Calculated Property
logPoct/wat	2.074		Crippen Calculated Property
McVol	221.640	ml/mol	McGowan Calculated Property
Inp	[2365.00; 2423.30]
Inp	2423.30		NIST
Inp	2365.00		NIST

Similar Compounds

Find more compounds similar to Lycoramine.

Sources

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

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