Tunnistetiedot

Cyclopentolate EP Impurity A

CAS 25209-52-3 · C13H16O3

01Tunnistetiedot

Lazychem IDLC-11562
CAS RN25209-52-3
PubChem CID91332
Molecular formulaC13H16O3
Molecular weight220.27 g/mol
IUPAC name(2RS)-(1-hydroxycyclopentyl)(phenyl)acetic acid
InChIKeyMHVVPVXRMHIATI-UHFFFAOYSA-N

02Rakenne ja stereokemia

2D structurePubChem CID 91332
Two-dimensional chemical structure of Cyclopentolate EP Impurity A, CAS 25209-52-3
Two-dimensional structure for the PubChem identity linked to this record. Confirm the identifiers before analytical use.

The parsed structure contains 2 rings, includes aromatic atoms, includes aliphatic carbon. These statements are calculated from the published structure string.

Defined stereocentres0
Ring count2
Secondary amines0
Tertiary amines0
SMILESC1CCC(C1)(C(C2=CC=CC=C2)C(=O)O)O
InChIEi ilmoitettu

03Stereochemistry

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

Defined centres0Structure assigned
Unassigned centres1Structure unspecified
Assignment statusUnassignedExact 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.

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

Cyclopentolate

Epäpuhtaudet ja lähiyhdisteet

Nimet ja suhteet

  • 1-Hydroxy-alpha-phenylcyclopentylacetic acid
  • 25209-52-3
  • (1-Hydroxycyclopentyl)phenylacetic acid
  • C1GZ2XU3YM
  • EINECS 246-733-1
  • NSC-61085
  • NSC-130953
  • CHEBI:59684
  • DTXSID901266818
  • 1-HYDROXY-.ALPHA.-PHENYLCYCLOPENTANEACETIC ACID
  • .ALPHA.-(1-HYDROXYCYCLOPENTYL)BENZENEACETIC ACID
  • .ALPHA.-(1-HYDROXYCYCLOPENTYL)PHENYLACETIC ACID

Epäpuhtaudet ja lähiyhdisteet

06Lähteet