Chemical Identity
Molecular Formula
C18H12Cl2N2O3
Molecular Weight
375.2 g/mol
Exact Mass
374.022498
PubChem CID
6450546
IUPAC Name
3-[(E)-3-anilino-3-oxoprop-1-enyl]-4,6-dichloro-1H-indole-2-carboxylic acid
SMILES String
O=C(/C=C/c1c(C(=O)O)[nH]c2cc(Cl)cc(Cl)c12)Nc1ccccc1
Names & Synonyms
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External Identifiers
Catalog Overview
Gavestinel, identified by CAS number 153436-22-7, is an organic compound with the molecular formula C18H12Cl2N2O3 and a molecular weight of 375.20 g/mol. Its IUPAC name is 3-[(E)-3-anilino-3-oxoprop-1-enyl]-4,6-dichloro-1H-indole-2-carboxylic acid. This compound features a dichloroindole carboxylic acid structure linked to a phenylcarbamoyl-ethenyl group. As a research-use-only chemical, Gavestinel is suitable for various laboratory investigations where its specific chemical properties or structural motifs are relevant.
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
210.0 °C
Boiling Point
450.0 °C
Density
1.51 g/cm³
Water Solubility
Slightly soluble
Flash Point
347.7 °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 Gavestinel in a well-ventilated area or under a fume hood. Wear appropriate personal protective equipment, including gloves, eye protection, and a lab coat. Avoid inhalation, ingestion, and skin contact. Consult the Safety Data Sheet (SDS) for detailed safety information and emergency procedures before use. 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 products and analog discovery will be available as catalog graph data is expanded.