3-(2-methylpiperidin-1-ium-1-yl)propyl 2-phenylbutanoate chloride

CAS: 66859-51-6

Molecular Formula	`C19H30ClNO2`
Molecular Weight	339.9 g/mol
Topological Polar Surface Area	30.7 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	3
Rotatable Bonds	8
Exact Mass	339.1965
Heavy Atoms	23
Complexity	325.0

Chemical Identifiers

CAS Number	66859-51-6
SMILES	`CCC(C1=CC=CC=C1)C(=O)OCCC[NH+]2CCCCC2C.[Cl-]`
InChIKey	`QEMYOWURCCUCSP-UHFFFAOYSA-N`

📖 Product Overview

3-(2-methylpiperidin-1-ium-1-yl)propyl 2-phenylbutanoate chloride (CAS: 66859-51-6) is a chemical compound with molecular formula C19H30ClNO2 and molecular weight 339.9 g/mol. Its IUPAC systematic name is 3-(2-methylpiperidin-1-ium-1-yl)propyl 2-phenylbutanoate chloride. Topological Polar Surface Area 30.7 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 3 Rotatable Bonds 8 Exact Mass 339.1965 Heavy Atoms 23 Complexity 325.0 InChI Key: QEMYOWURCCUCSP-UHFFFAOYSA-N. SMILES: CCC(C1=CC=CC=C1)C(=O)OCCC[NH+]2CCCCC2C.[Cl-].

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