Chemical identity

Captopril EP Impurity D

CAS 56970-78-6 · C4H7BrO2

01Identity

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

Lazychem IDLC-09352
PubChem CID304776
NameCaptopril EP Impurity D
CAS RN56970-78-6
Molecular formulaC4H7BrO2
Molecular weight167.00 g/mol
IUPAC name(2RS)-3-bromo-2-methylpropanoic acid
InChIKeyBUPXDXGYFXDDAA-UHFFFAOYSA-N

02Structure identifiers

2D structurePubChem CID 304776
2D structure: Captopril EP Impurity D, CAS 56970-78-6
Structure of Captopril EP Impurity D (CAS 56970-78-6). LazyChem record. Source identity: PubChem CID 304776. Confirm the identifiers before analytical use.Download structure image

Structure facts for this exact identity.

Molecular formulaC4H7BrO2
InChIKeyBUPXDXGYFXDDAA-UHFFFAOYSA-N
Ring count0
Defined stereocentres0
Unassigned stereocentres1
SMILESCC(CBr)C(=O)O
InChIInChI=1S/C4H7BrO2/c1-3(2-5)4(6)7/h3H,2H2,1H3,(H,6,7)

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 56970-78-6 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 56970-78-6 was not found in the reviewed exact-CAS mapping. Generic and analogue entries were not evaluated.

05Names and relationships

Associated parent compound

Captopril

View API and impurity family

Other names

  • Captopril Bromo Acid
  • 3-Bromo-2-methylpropionic acid
  • Propanoic acid, 3-bromo-2-methyl-
  • UNII-07304AI75I
  • .BETA.-BROMOISOBUTANOIC ACID
  • CAPTOPRIL IMPURITY D [EP IMPURITY]
  • PROPIONIC ACID, 3-BROMO-2-METHYL-
  • (2RS)-3-BROMO-2-METHYLPROPANOIC ACID

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