Chemical identity

Ketorolac EP Impurity C / 6-Benzoyl Ketorolac Isomer

CAS 1026936-07-1 · C15H13NO3

01Identity

Identifiers and names for this exact compound. Empty fields are left unassigned.

Lazychem IDLC-17877
PubChem CID10198970
NameKetorolac EP Impurity C / 6-Benzoyl Ketorolac Isomer
CAS RN1026936-07-1
Molecular formulaC15H13NO3
Molecular weight255.27 g/mol
IUPAC name(1RS)-6-Benzoyl-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid
InChIKeyDJZUDKBHTXZJRO-UHFFFAOYSA-N

02Structure identifiers

2D structurePubChem CID 10198970
2D structure: Ketorolac EP Impurity C / 6-Benzoyl Ketorolac Isomer, CAS 1026936-07-1
Structure of Ketorolac EP Impurity C / 6-Benzoyl Ketorolac Isomer (CAS 1026936-07-1). LazyChem record. Source identity: PubChem CID 10198970. Confirm the identifiers before analytical use.Download structure image

Structure facts for this exact identity.

Molecular formulaC15H13NO3
InChIKeyDJZUDKBHTXZJRO-UHFFFAOYSA-N
Ring count3
Defined stereocentres0
Unassigned stereocentres1
SMILESC1CN2C=C(C=C2C1C(=O)O)C(=O)C3=CC=CC=C3
InChIInChI=1S/C15H13NO3/c17-14(10-4-2-1-3-5-10)11-8-13-12(15(18)19)6-7-16(13)9-11/h1-5,8-9,12H,6-7H2,(H,18,19)

03Stereochemistry

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

Defined stereocentres02D structure
Unassigned stereocentres12D structure
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.

04India status for this compound

These results apply only to this exact compound name and CAS number. Confirm the current official instruments before making a regulatory decision.

NDPS / RCSNOT FOUND IN REVIEWED ENTRIESCAS 1026936-07-1 was not found in the reviewed exact-identity entries. Generic, class, analogue, salt and isomer provisions were not evaluated.
SCOMETNOT FOUND IN REVIEWED CAS ENTRIESCAS 1026936-07-1 was not found in the reviewed exact-CAS mapping. Generic and analogue entries were not evaluated.

05Names and relationships

Associated parent compound

Ketorolac

View API and impurity family

Other names

  • Ketorolac EP Impurity C
  • 6-Benzoyl Ketorolac Isomer

Related records from the same parent family

06Documented history

Dated discovery, occurrence, use and issue claims are published only when a suitable primary or government source is available.

No dated history available

No verified discovery, first report, occurrence, use or issue event is currently available for this identity.

07Sources