3-(4-methylpiperazin-1-ium-1-yl)propyl 2-ethyl-2-methylhexanoate chloride

CAS: 31364-63-3

Molecular Formula	`C17H35ClN2O2`
Molecular Weight	334.9 g/mol
Topological Polar Surface Area	34.0 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	4
Rotatable Bonds	10
Exact Mass	334.2387
Heavy Atoms	22
Complexity	301.0

Chemical Identifiers

CAS Number	31364-63-3
SMILES	`CCCCC(C)(CC)C(=O)OCCC[NH+]1CCN(CC1)C.[Cl-]`
InChIKey	`WKVKEPHQOIKPIH-UHFFFAOYSA-N`

📖 Product Overview

3-(4-methylpiperazin-1-ium-1-yl)propyl 2-ethyl-2-methylhexanoate chloride (CAS: 31364-63-3) is a chemical compound with molecular formula C17H35ClN2O2 and molecular weight 334.9 g/mol. Its IUPAC systematic name is 3-(4-methylpiperazin-1-ium-1-yl)propyl 2-ethyl-2-methylhexanoate chloride. Topological Polar Surface Area 34.0 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 4 Rotatable Bonds 10 Exact Mass 334.2387 Heavy Atoms 22 Complexity 301.0 InChI Key: WKVKEPHQOIKPIH-UHFFFAOYSA-N. SMILES: CCCCC(C)(CC)C(=O)OCCC[NH+]1CCN(CC1)C.[Cl-].

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