(3-cyclohexyl-3-hydroxy-3-phenylpropyl)-triethylazaniumhexane-1-sulfonate

(3-cyclohexyl-3-hydroxy-3-phenylpropyl)-triethylazanium;hexane-1-sulfonate

CAS: 67603-58-1

Molecular Formula	`C27H49NO4S`
Molecular Weight	483.7 g/mol
Topological Polar Surface Area	85.8 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	4
Rotatable Bonds	12
Exact Mass	483.33823
Heavy Atoms	33
Complexity	459.0

Chemical Identifiers

CAS Number	67603-58-1
SMILES	`CCCCCCS(=O)(=O)[O-].CC[N+](CC)(CC)CCC(C1CCCCC1)(C2=CC=CC=C2)O`
InChIKey	`JGBVGHHRZQOWSW-UHFFFAOYSA-M`

📖 Product Overview

(3-cyclohexyl-3-hydroxy-3-phenylpropyl)-triethylazaniumhexane-1-sulfonate (CAS: 67603-58-1) is a chemical compound with molecular formula C27H49NO4S and molecular weight 483.7 g/mol. Its IUPAC systematic name is (3-cyclohexyl-3-hydroxy-3-phenylpropyl)-triethylazanium;hexane-1-sulfonate. Topological Polar Surface Area 85.8 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 4 Rotatable Bonds 12 Exact Mass 483.33823 Heavy Atoms 33 Complexity 459.0 InChI Key: JGBVGHHRZQOWSW-UHFFFAOYSA-M. SMILES: CCCCCCS(=O)(=O)[O-].CC[N+](CC)(CC)CCC(C1CCCCC1)(C2=CC=CC=C2)O.

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