(1-methylpiperidin-1-ium-4-yl)methyl 2-hydroxy-2-phenylpent-3-ynoate chloride

CAS: 92956-06-4

Molecular Formula	`C18H24ClNO3`
Molecular Weight	337.8 g/mol
Topological Polar Surface Area	51.0 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	4
Rotatable Bonds	6
Exact Mass	337.14447
Heavy Atoms	23
Complexity	436.0

Chemical Identifiers

CAS Number	92956-06-4
SMILES	`CC#CC(C1=CC=CC=C1)(C(=O)OCC2CC[NH+](CC2)C)O.[Cl-]`
InChIKey	`UJUVWGIKJDOTSI-UHFFFAOYSA-N`

📖 Product Overview

(1-methylpiperidin-1-ium-4-yl)methyl 2-hydroxy-2-phenylpent-3-ynoate chloride (CAS: 92956-06-4) is a chemical compound with molecular formula C18H24ClNO3 and molecular weight 337.8 g/mol. Its IUPAC systematic name is (1-methylpiperidin-1-ium-4-yl)methyl 2-hydroxy-2-phenylpent-3-ynoate chloride. Topological Polar Surface Area 51.0 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 4 Rotatable Bonds 6 Exact Mass 337.14447 Heavy Atoms 23 Complexity 436.0 InChI Key: UJUVWGIKJDOTSI-UHFFFAOYSA-N. SMILES: CC#CC(C1=CC=CC=C1)(C(=O)OCC2CC[NH+](CC2)C)O.[Cl-].

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