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tert-Butyl (5-fluoro-2-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)carbamate

CAS 1931066-90-8Formula C18H27BFNO4MW 351.2PubChem 145083260

This compound is a fluorinated phenyl carbamate derivative featuring a pinacol boronate ester. It serves as a versatile building block in organic synthesis, particularly for Suzuki-Miyaura cross-coupling reactions, and is intended for research use.

Loading RDKit molecule structure...
InChIKey: VOUDGUUBKHGUAM-UHFFFAOYSA-NC18H27BFNO4 | MW 351.2

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
SCHEMBL17780123SCHEMBL29976746DB-404751EN300-28298601

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

Estimated

Estimated / 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

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
  • 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.

Related Products / Graph Discovery

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

Similar products (text references)

897017-00-4CAS 897017-00-4
1092563-48-8CAS 1092563-48-8
1251529-11-9CAS 1251529-11-9

Recommended application cues

Research intermediateCustom synthesis building block

Catalog discovery cues, not supplier-verified claims.

Related HS Code / Compliance

HS Code: 29319090GHS Pictograms: GHS07Shipment review: Shipment details require review before fulfillment.

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

Catalog navigation

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