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5-(4-bromo-2-fluoroanilino)-4-fluoro-1-methyl-1H-benzimidazole-6-carboxylic acid

CAS 1415564-99-6Formula C15H10BrF2N3O2MW 382.16PubChem 21114161

5-(4-bromo-2-fluoroanilino)-4-fluoro-1-methyl-1H-benzimidazole-6-carboxylic acid is a complex organic compound with the molecular formula C15H10BrF2N3O2 and a molecular weight of 382.16. This benzimidazole derivative is primarily intended for research and development applications.

Loading RDKit molecule structure...
InChIKey: YBTSZTNYTYAQKE-UHFFFAOYSA-NC15H10BrF2N3O2 | MW 382.16

Chemical Identity

Molecular Formula

C15H10BrF2N3O2

Molecular Weight

382.16 g/mol

Exact Mass

380.99245

PubChem CID

21114161

IUPAC Name

6-(4-bromo-2-fluoroanilino)-7-fluoro-3-methylbenzimidazole-5-carboxylic acid

SMILES String

Cn1cnc2c(F)c(Nc3ccc(Br)cc3F)c(C(=O)O)cc21

Names & Synonyms

815-319-85-((4-bromo-2-fluorophenyl)amino)-4-fluoro-1-methyl-1H-benzo[d]imidazole-6-carboxylic acid5-((4-Bromo-2-fluorophenyl)amino)-4-fluoro-1-methyl-1H-benzo[d]imidazole-6-carboxylicacid2RUK6LP5RJCS-M1944
Show all synonyms
D72212F7894321H-Benzimidazole-6-carboxylic acid, 5-[(4-bromo-2-fluorophenyl)amino]-4-fluoro-1-methyl-5-[(4-Bromo-2-fluorophenyl)amino]-4-fluoro-1-methylbenzimidazole-6-carboxylic Acid6-(4-bromo-2-fluoro-anilino)-7-fluoro-3-methyl-benzimidazole-5-carboxylic acid
External Identifiers
RefChem:530164MFCD22571244SCHEMBL2880277SCHEMBL29552961SCHEMBL29990156AKOS030621748CS-17098SY284751

Catalog Overview

This chemical, identified by CAS Number 1415564-99-6, is 5-(4-bromo-2-fluoroanilino)-4-fluoro-1-methyl-1H-benzimidazole-6-carboxylic acid. It features a benzimidazole core substituted with a 4-bromo-2-fluoroanilino group, a fluoro group, a methyl group, and a carboxylic acid functionality. With a molecular weight of 382.16 and an exact mass of 380.992450, this compound is classified within the research-oriented chemical scaffold, suggesting its potential utility in medicinal chemistry and related research fields. It is supplied for research use only.

Use Context

  • Research chemical sourcing
  • Custom synthesis and catalog availability review
  • COA, SDS, pricing, and fulfillment workflow

Physical Data

Estimated

Estimated / predicted physical property values for catalog reference.

Appearance

White to off-white solid

Physical State

Solid

Melting Point

240.0 °C

Boiling Point

449.1 °C

Density

1.71 g/cm³

Water Solubility

5.59 × 10⁻⁶ mol/L

Flash Point

299.1 °C

Applications / Classifications

Research intermediateCustom synthesis building block

Biological Target Reference

No verified biological target assignment. This compound is listed primarily as a research or synthetic intermediate.

Preliminary Safety-Style Reference

Preliminary

Preliminary safety-style information for reference only. Not a supplier SDS.

Handling and Storage
  • When handling 5-(4-bromo-2-fluoroanilino)-4-fluoro-1-methyl-1H-benzimidazole-6-carboxylic acid, always wear appropriate personal protective equipment, including gloves, eye protection, and a lab coat. Work in a well-ventilated area or under a fume hood to minimize exposure. Avoid inhalation, ingestion, and skin or eye contact. Store the compound in a cool, dry place, away from incompatible materials. Dispose of waste according to local regulations for chemical waste.

Related Products / Graph Discovery

Related products, derivatives, keywords, and application cues for catalog discovery.

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Recommended application cues

Research intermediateCustom synthesis building block

Catalog discovery cues, not supplier-verified claims.

Related HS Code / Compliance

HS Code: 293399GHS Pictograms: GHS07Shipment review: Shipment details require review before fulfillment.

Compliance cues are non-linked reference tags and require shipment review.

Catalog navigation

Related catalog entries

Other public CAS pages in this catalog. These links support navigation across additional intermediates and do not imply equivalence, availability, or shared use.

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