Compound C28H44ClNO2

benzyl-dimethyl-[2-[2-[3-methyl-4-(2,4,4-trimethylpentan-2-yl)phenoxy]ethoxy]ethyl]azanium chloride

CAS: 15716-02-6

Molecular Formula	`C28H44ClNO2`
Molecular Weight	462.1 g/mol
Topological Polar Surface Area	18.5 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	3
Rotatable Bonds	12
Exact Mass	461.30606
Heavy Atoms	32
Complexity	502.0

Chemical Identifiers

CAS Number	15716-02-6
SMILES	`CC1=C(C=CC(=C1)OCCOCC[N+](C)(C)CC2=CC=CC=C2)C(C)(C)CC(C)(C)C.[Cl-]`
InChIKey	`WYWSKWZUWZLELX-UHFFFAOYSA-M`

📖 Product Overview

Compound C28H44ClNO2 (CAS: 15716-02-6) is a chemical compound with molecular formula C28H44ClNO2 and molecular weight 462.1 g/mol. Its IUPAC systematic name is benzyl-dimethyl-[2-[2-[3-methyl-4-(2,4,4-trimethylpentan-2-yl)phenoxy]ethoxy]ethyl]azanium chloride. Topological Polar Surface Area 18.5 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 3 Rotatable Bonds 12 Exact Mass 461.30606 Heavy Atoms 32 Complexity 502.0 InChI Key: WYWSKWZUWZLELX-UHFFFAOYSA-M. SMILES: CC1=C(C=CC(=C1)OCCOCC[N+](C)(C)CC2=CC=CC=C2)C(C)(C)CC(C)(C)C.[Cl-].

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