Chemical Properties of Pipecolylpipecolic acid, N-propoxycarbonyl-, decyl ester

InChI

InChI=1S/C26H46N2O5/c1-3-5-6-7-8-9-10-15-21-32-25(30)23-17-12-13-18-27(23)24(29)22-16-11-14-19-28(22)26(31)33-20-4-2/h22-23H,3-21H2,1-2H3

InChI Key

KNKOHPXMJLRYLG-UHFFFAOYSA-N

Formula

C26H46N2O5

SMILES

CCCCCCCCCCOC(=O)C1CCCCN1C(=O)C1CCCCN1C(=O)OCCC

Molecular Weight¹

466.65

• 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
logPoct/wat	5.452		Crippen Calculated Property
McVol	391.890	ml/mol	McGowan Calculated Property
Inp	[3245.00; 3245.00]
Inp	3245.00		NIST
Inp	3245.00		NIST

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Similar Compounds

Find more compounds similar to Pipecolylpipecolic acid, N-propoxycarbonyl-, decyl ester.

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
• McGowan Method
• NIST Webbook

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