Chemical Identity
Molecular Formula
C8H7F5O2S
Molecular Weight
262.2 g/mol
Exact Mass
262.008691
PubChem CID
66523588
IUPAC Name
2-methyl-5-(pentafluoro-lambda6-sulfanyl)benzoic acid
SMILES String
Cc1ccc(S(F)(F)(F)(F)F)cc1C(=O)O
Names & Synonyms
External Identifiers
Catalog Overview
2-Methyl-5-(pentafluorosulfur)benzoic acid is an organic compound featuring a benzoic acid core substituted with a methyl group and a pentafluorosulfur (SF5) group. The SF5 group is known for its strong electron-withdrawing properties, high metabolic stability, and lipophilicity, making it a valuable moiety in medicinal chemistry and materials science. This compound serves as a versatile building block for the synthesis of novel chemical entities, particularly in the development of pharmaceuticals, agrochemicals, and advanced materials where the unique characteristics of the SF5 group are desired to modulate physicochemical and...
Use Context
- Research chemical sourcing
- Custom synthesis and catalog availability review
- COA, SDS, pricing, and fulfillment workflow
Read more catalog context
2-Methyl-5-(pentafluorosulfur)benzoic acid is an organic compound featuring a benzoic acid core substituted with a methyl group and a pentafluorosulfur (SF5) group. The SF5 group is known for its strong electron-withdrawing properties, high metabolic stability, and lipophilicity, making it a valuable moiety in medicinal chemistry and materials science. This compound serves as a versatile building block for the synthesis of novel chemical entities, particularly in the development of pharmaceuticals, agrochemicals, and advanced materials where the unique characteristics of the SF5 group are desired to modulate physicochemical and biological properties.
Physical Data
EstimatedEstimated / predicted physical property values for catalog reference.
Appearance
White solid
Physical State
Solid
Melting Point
160.0 °C
Boiling Point
300.0 °C
Density
1.6 g/cm³
Water Solubility
Slightly soluble
Flash Point
175.0 °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 2-Methyl-5-(pentafluorosulfur)benzoic acid in a well-ventilated area or fume hood. Wear appropriate personal protective equipment, including safety glasses, gloves, and a lab coat, to prevent skin and eye contact. Avoid inhalation of dust or vapors. Ensure proper storage in a cool, dry place, away from incompatible materials. Dispose of waste in accordance with local regulations for chemical waste. This product is for research use only and not for human or animal therapeutic or diagnostic use.
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.