Chemical Identity
Molecular Formula
C18H27BFNO4
Molecular Weight
351.2 g/mol
Exact Mass
351.201717
PubChem CID
145083260
IUPAC Name
tert-butyl N-[5-fluoro-2-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]carbamate
SMILES String
Cc1c(NC(=O)OC(C)(C)C)cc(F)cc1B1OC(C)(C)C(C)(C)O1
External Identifiers
Catalog Overview
tert-Butyl (5-fluoro-2-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)carbamate, identified by CAS 1931066-90-8, is a sophisticated organic intermediate. Its structure incorporates a tert-butyl carbamate protecting group on an aniline derivative, a fluorine atom, a methyl group, and a pinacol boronate ester moiety. The boronate ester makes it highly valuable for carbon-carbon bond formation reactions, such as Suzuki-Miyaura coupling, enabling the synthesis of complex fluorinated aromatic compounds. The carbamate group offers protection for the amine functionality and can be selectively deprotected under acidic...
Use Context
- Research chemical sourcing
- Custom synthesis and catalog availability review
- COA, SDS, pricing, and fulfillment workflow
Read more catalog context
tert-Butyl (5-fluoro-2-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)carbamate, identified by CAS 1931066-90-8, is a sophisticated organic intermediate. Its structure incorporates a tert-butyl carbamate protecting group on an aniline derivative, a fluorine atom, a methyl group, and a pinacol boronate ester moiety. The boronate ester makes it highly valuable for carbon-carbon bond formation reactions, such as Suzuki-Miyaura coupling, enabling the synthesis of complex fluorinated aromatic compounds. The carbamate group offers protection for the amine functionality and can be selectively deprotected under acidic conditions. This compound is primarily intended for research and development applications in synthetic chemistry.
Physical Data
EstimatedEstimated / predicted physical property values for catalog reference.
Appearance
White to off-white powder
Physical State
Solid
Melting Point
120.0 °C
Boiling Point
350.0 °C
Density
1.2 g/cm³
Water Solubility
Very slightly soluble
Flash Point
220.0 °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 with appropriate personal protective equipment, including gloves, eye protection, and a lab coat. Use in a well-ventilated area or fume hood to avoid inhalation. Avoid contact with skin and eyes. In case of contact, rinse immediately with plenty of water. Store in a cool, dry place, away from incompatible materials. Consult the Safety Data Sheet (SDS) for comprehensive safety information before use. This product is for research use only and not for human or animal therapeutic or diagnostic use.
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Related CAS / Similar Products
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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.