Chemical Identity
Molecular Formula
C17H11ClFNO3
Molecular Weight
331.7 g/mol
Exact Mass
331.041149
PubChem CID
3544178
IUPAC Name
1-[(2-chloro-4-fluorophenyl)methyl]-3-formylindole-2-carboxylic acid
SMILES String
O=Cc1c(C(=O)O)n(Cc2ccc(F)cc2Cl)c2ccccc12
Names & Synonyms
External Identifiers
Catalog Overview
1-(2-chloro-4-fluorobenzyl)-3-formyl-1H-indole-2-carboxylic acid, identified by CAS 903160-22-5, is an organic compound with the molecular formula C17H11ClFNO3 and a molecular weight of 331.70. Structurally, it features an indole core substituted at the 1-position with a 2-chloro-4-fluorobenzyl group, at the 3-position with a formyl group, and at the 2-position with a carboxylic acid. This compound is classified within the research-oriented chemical scaffold, suggesting its potential relevance in medicinal chemistry and drug discovery research as a building block or lead compound. It is intended strictly for Research Use Only (RUO).
Use Context
- Research chemical sourcing
- Custom synthesis and catalog availability review
- COA, SDS, pricing, and fulfillment workflow
Physical Data
EstimatedEstimated / predicted physical property values for catalog reference.
Appearance
White to off-white solid
Physical State
Solid
Melting Point
195.0 °C
Boiling Point
450.0 °C
Density
1.45 g/cm³
Water Solubility
>49.8 [ug/mL] (The mean of the results at pH 7.4)
Flash Point
280.0 °C
Applications / Classifications
Biological Target Reference
No verified biological target assignment. This compound is listed primarily as a research or synthetic intermediate.
Preliminary Safety-Style Reference
PreliminaryPreliminary safety-style information for reference only. Not a supplier SDS.
Handling and Storage
- Handle 1-(2-chloro-4-fluorobenzyl)-3-formyl-1H-indole-2-carboxylic acid in a well-ventilated area or fume hood. Wear appropriate personal protective equipment, including safety glasses, gloves, and a lab coat. Avoid inhalation, ingestion, and skin contact. In case of contact, wash thoroughly with water. Consult the Safety Data Sheet (SDS) for comprehensive safety information and emergency procedures. Store in a cool, dry place, away from incompatible materials.
Related Products / Graph Discovery
Related products, derivatives, keywords, and application cues for catalog discovery.
Related CAS / Similar Products
Similar products (text references)
Recommended application cues
Catalog discovery cues, not supplier-verified claims.
Related HS Code / Compliance
Compliance cues are non-linked reference tags and require shipment review.