Tunnistetiedot

Cethexonium Bromide

CAS 1794-74-7 · C24H50BrNO

01Tunnistetiedot

Lazychem IDLC-101243
CAS RN1794-74-7
PubChem CID3083735
Molecular formulaC24H50BrNO
Molecular weight448.6 g/mol
IUPAC namehexadecyl-(2-hydroxycyclohexyl)-dimethylazanium bromide
InChIKeyMFLMYFVIROLIRS-UHFFFAOYSA-M

02Rakenne ja stereokemia

2D structurePubChem CID 3083735
Two-dimensional chemical structure of Cethexonium Bromide, CAS 1794-74-7
Two-dimensional structure for the PubChem identity linked to this record. Confirm the identifiers before analytical use.

The parsed structure contains 1 ring, includes aliphatic carbon, contains at least one halogen atom. These statements are calculated from the published structure string.

Defined stereocentres0
Ring count1
Secondary amines0
Tertiary amines0
SMILESCCCCCCCCCCCCCCCC[N+](C)(C)C1CCCCC1O.[Br-]
InChIEi ilmoitettu

03Stereochemistry

The published structure contains 0 defined and 2 unassigned tetrahedral stereocentres. The exact wedge and dash depiction is shown above.

Defined centres0Structure assigned
Unassigned centres2Structure unspecified
Assignment statusUnassignedExact published identity
Tetrahedral upper bound≤ 4Before symmetry reduction

Published same-connectivity configurations

1 record

These records have the same connectivity, molecular formula and protonation layer, but a different complete InChIKey stereochemical layer. Only separately structure-linked records are shown.

No additional structure-linked configuration with the same connectivity is currently present in the LazyChem dataset.

Scope: The mathematical 2^n value is only an upper bound. Symmetry and other stereogenic elements can change the number of distinct stereoisomers. A hypothetical configuration is not published as a compound record without a verified structure identity.

04Tila Intiassa

Exact-compound status is evaluated only against the published name and CAS number. Confirm the current official instrument before a regulatory decision.

05Nimet ja suhteet

API ja emolääke

Ei ilmoitettu

Nimet ja suhteet

  • Cethexonium bromide
  • 1794-74-7
  • F3T95WRD7W
  • BACTYL
  • MONOSEPT
  • Cyclohexanaminium, N-hexadecyl-2-hydroxy-N,N-dimethyl-, bromide
  • CYCLOHEXANAMINIUM, N-HEXADECYL-2-HYDROXY-N,N-DIMETHYL-, BROMIDE (1:1)
  • RefChem:124692
  • Bromure de cethexonium
  • UNII-F3T95WRD7W
  • Biocidan
  • hexadecyl-(2-hydroxycyclohexyl)-dimethylazanium

Epäpuhtaudet ja lähiyhdisteet

    06Lähteet