Identita

(S)-Phenylephrine Hydrochloride

CAS 939-38-8 · C9H14ClNO2

01Identita

Lazychem IDLC-00888
CAS RN939-38-8
PubChem CID16745125
Molecular formulaC9H14ClNO2
Molecular weight203.67
IUPAC name(αS)-3-Hydroxy-α-[(methylamino)methyl]benzenemethanol Hydrochloride
InChIKeyOCYSGIYOVXAGKQ-SBSPUUFOSA-N

02Struktura a stereochemie

2D structurePubChem CID 16745125
Two-dimensional chemical structure of (S)-Phenylephrine Hydrochloride, CAS 939-38-8
Two-dimensional structure for the PubChem identity linked to this record. Confirm the identifiers before analytical use.

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

Defined stereocentres1
Ring count1
Secondary amines1
Tertiary amines0
SMILESCNC[C@H](C1=CC(=CC=C1)O)O.Cl
InChINeuvedeno

03Stereochemistry

The published structure contains 1 defined and 0 unassigned tetrahedral stereocentre. The exact wedge and dash depiction is shown above.

Defined centres1Structure assigned
Unassigned centres0Structure unspecified
Assignment statusFully assignedExact published identity
Tetrahedral upper bound≤ 2Before 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.

04Stav v Indii

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

05Názvy a vztahy

API a mateřské léčivo

Phenylephrine

Nečistoty a související sloučeniny

Názvy a vztahy

  • (+)-Phenylephrine hydrochloride
  • 939-38-8
  • (S)-Phenylephrine Hydrochloride
  • S(+)-Mezaton hydrochloride
  • (+)-Phenylephrine HCl
  • UNII-95T627AGR3
  • 95T627AGR3
  • Phenylephrine hydrochloride, (S)-
  • S(+)-1-(m-Hydroxyphenyl)-2-methylaminoethanol hydrochloride
  • (+)-m-Hydroxy-alpha-((methylamino)methyl)benzyl alcohol hydrochloride
  • BENZYL ALCOHOL, m-HYDROXY-alpha-((METHYLAMINO)METHYL)-, HYDROCHLORIDE, (+)-
  • BENZENEMETHANOL, 3-HYDROXY-.ALPHA.-((METHYLAMINO)METHYL)-, HYDROCHLORIDE, (.ALPHA.S)-

Nečistoty a související sloučeniny

06Zdroje