3-(2-hydroxy-3-methyl-2-phenylbutanoyl)oxypropyl-dimethylazanium chloride

CAS: 60452-19-9

Molecular Formula	`C16H26ClNO3`
Molecular Weight	315.83 g/mol
Topological Polar Surface Area	51.0 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	4
Rotatable Bonds	8
Exact Mass	315.16013
Heavy Atoms	21
Complexity	298.0

Chemical Identifiers

CAS Number	60452-19-9
SMILES	`CC(C)C(C1=CC=CC=C1)(C(=O)OCCC[NH+](C)C)O.[Cl-]`
InChIKey	`XXUMSZSOCZWEAS-UHFFFAOYSA-N`

📖 Product Overview

3-(2-hydroxy-3-methyl-2-phenylbutanoyl)oxypropyl-dimethylazanium chloride (CAS: 60452-19-9) is a chemical compound with molecular formula C16H26ClNO3 and molecular weight 315.83 g/mol. Its IUPAC systematic name is 3-(2-hydroxy-3-methyl-2-phenylbutanoyl)oxypropyl-dimethylazanium chloride. Topological Polar Surface Area 51.0 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 4 Rotatable Bonds 8 Exact Mass 315.16013 Heavy Atoms 21 Complexity 298.0 InChI Key: XXUMSZSOCZWEAS-UHFFFAOYSA-N. SMILES: CC(C)C(C1=CC=CC=C1)(C(=O)OCCC[NH+](C)C)O.[Cl-].

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