Chemical Properties of Piperocaine (CAS 136-82-3)

InChI

InChI=1S/C16H23NO2/c1-14-8-5-6-11-17(14)12-7-13-19-16(18)15-9-3-2-4-10-15/h2-4,9-10,14H,5-8,11-13H2,1H3

InChI Key

YQKAVWCGQQXBGW-UHFFFAOYSA-N

Formula

C16H23NO2

SMILES

CC1CCCCN1CCCOC(=O)c1ccccc1

Molecular Weight¹

261.36

CAS

136-82-3

Other Names

• 1-Piperidinepropanol, 2-methyl-, benzoate (ester), (.+/-.)-
• «gamma»-(2-Methylpiperidyl)propyl benzoate
• (2-Methylpiperidino)propyl benzoate
• Metycaine
• Neothesin
• 2-Methyl-1-piperidinepropanol, benzoate
• 3-(2-Methyl-1-piperidyl)propyl benzoate
• 3-Benzoxy-1-(2-methylpiperidino)propane
• 1-Piperidinepropanol, 2-methyl-, benzoate, (.+/-.)-
• 3-(2-Methylpiperidino)propyl benzoate
• 1-Piperidinepropanol, 2-methyl-, benzoate (ester)
• Isocaine base

• 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	-3.64		Crippen Calculated Property
logPoct/wat	3.108		Crippen Calculated Property
McVol	219.100	ml/mol	McGowan Calculated Property
Inp	[1980.00; 1984.00]
Inp	1984.00		NIST
Inp	1980.00		NIST
Inp	1984.00		NIST

Similar Compounds

Find more compounds similar to Piperocaine.

Sources

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

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.