Hexocyclium
CAS Registry Number®
6004-98-4
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CAS Name
HexocycliumMolecular Formula
C20H33N2OCite this Page
Hexocyclium. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=6004-98-4 (retrieved ) (CAS RN: 6004-98-4). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C20H33N2O/c1-22(2)15-13-21(14-16-22)17-20(23,18-9-5-3-6-10-18)19-11-7-4-8-12-19/h3,5-6,9-10,19,23H,4,7-8,11-17H2,1-2H3/q+1
InChIKey
InChIKey=ZRYHPQCHHOKSMD-UHFFFAOYSA-N
SMILES
C(CN1CC[N+](C)(C)CC1)(O)(C2CCCCC2)C3=CC=CC=C3
Canonical SMILES
OC(C=1C=CC=CC1)(CN2CC[N+](C)(C)CC2)C3CCCCC3
Other Names for this Substance
- Piperazinium, 4-(2-cyclohexyl-2-hydroxy-2-phenylethyl)-1,1-dimethyl-
- Piperazinium, 4-(β-cyclohexyl-β-hydroxyphenethyl)-1,1-dimethyl-
- 4-(2-Cyclohexyl-2-hydroxy-2-phenylethyl)-1,1-dimethylpiperazinium
- Hexocyclium
Deleted or Replaced CAS Registry Numbers
150350-96-2
