Chemical identity

Aceclofenac-D7

CAS not listed · C16H13Cl2NO4

01Identity

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

Lazychem IDLC-119456
PubChem CID177834496
NameAceclofenac-D7
CAS RNNot listed
Molecular formulaC16H13Cl2NO4
Molecular weight361.2 g/mol
IUPAC name2-[2-[2,3,4,5-tetradeuterio-6-(2,6-dichloro-3,4,5-trideuterioanilino)phenyl]acetyl]oxyacetic acid
InChIKeyMNIPYSSQXLZQLJ-GSNKEKJESA-N

02Structure identifiers

2D structurePubChem CID 177834496
2D structure: Aceclofenac-D7
Structure of Aceclofenac-D7. LazyChem record. Source identity: PubChem CID 177834496. Confirm the identifiers before analytical use.Download structure image

Structure facts for this exact identity.

Molecular formulaC16H13Cl2NO4
InChIKeyMNIPYSSQXLZQLJ-GSNKEKJESA-N
Ring count2
Defined stereocentres0
Unassigned stereocentres0
SMILES[2H]C1=C(C(=C(C(=C1[2H])CC(=O)OCC(=O)O)NC2=C(C(=C(C(=C2Cl)[2H])[2H])[2H])Cl)[2H])[2H]
InChIInChI=1S/C16H13Cl2NO4/c17-11-5-3-6-12(18)16(11)19-13-7-2-1-4-10(13)8-15(22)23-9-14(20)21/h1-7,19H,8-9H2,(H,20,21)/i1D,2D,3D,4D,5D,6D,7D

03Possible N-nitroso structures

A record-level structural review indicates a possible N-nitroso candidate. This is not a confirmed impurity, formation prediction or analytical finding.

Possible structure candidateUnconfirmed identity
Possible N-nitroso structural candidate related to Aceclofenac-D7
No CAS number, formation claim or analytical confirmation is assigned.

A structural result alone does not establish that a nitrosamine forms. A process-specific and analytical assessment is required.

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 ENTRIESNo CAS number is available for an exact comparison. Generic and analogue entries were not evaluated.
SCOMETNOT FOUND IN REVIEWED CAS ENTRIESNo CAS number is available for an exact comparison. Generic and analogue entries were not evaluated.

05Names and relationships

Associated parent compound

Aceclofenac

View API and impurity family

Other names

  • Aceclofenac-d7

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