Research chemical
CAS Number: 2225155-69-9
Product details
For laboratory research and professional procurement workflows.
PubChem CID
91882705
Exact Mass
268.94706
InChIKey
PXLSISUTOYTYBM-UHFFFAOYSA-N
IUPAC Name
[5-bromo-6-(trifluoromethyl)-3-pyridinyl]boronic acid
SMILES String
OB(O)c1cnc(C(F)(F)F)c(Br)c1
Appearance
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.
5-Bromo-6-(trifluoromethyl)pyridin-3-ylboronic acid is identified by CAS 2225155-69-9, with molecular formula C6H4BBrF3NO2, molecular weight 269.81, InChIKey PXLSISUTOYTYBM-UHFFFAOYSA-N.
Yes. Submit an RFQ and specify COA requirements. Lot-specific COA depends on supplier confirmation.
Yes. Supplier SDS can be requested through the RFQ workflow before handling, storage, shipment, or procurement decisions.
Availability, pack size, lead time, and pricing are confirmed through RFQ.
Submit the CAS number, quantity, purity requirement, and destination country for sourcing review.
White to off-white crystalline powder
Physical State
Solid
Melting Point
185.0 °C
Boiling Point
350.0 °C
Density
1.75 g/cm³
Water Solubility
Slightly soluble
Flash Point
195.0 °C
Vapor Pressure
Estimated very low; unit not specified
Autoignition Temp
420.0 °C
Properties are provided as catalog reference data and may be confirmed through supplier documentation when required.
Heavy atom count
14
H-bond acceptors
3
H-bond donors
2
Rotatable bonds
1
Ring count
1
Aromatic rings
1
Topological polar surface area
53.35 Ų
Computed LogP
0.54
Fragment-like structure rule
Yes
Lead-like structure rule
Yes
Drug-like structure rule
Yes
Structure family
n heterocycle ligand
Precious metal motif
No
Transition metal motif
No
Phosphine ligand motif
No
N-heterocycle motif
Yes
Boronic acid motif
Yes
Computed structure descriptors generated from molecular structure. These are not experimental physical property values, supplier specifications, SDS data, or bioactivity claims.
Structural features
5-Bromo-6-(trifluoromethyl)pyridin-3-ylboronic acid is a pyridine-based boronic acid derivative, commonly employed as a versatile building block in organic synthesis.
Sourcing context
Catalog reference for RFQ preparation, supplier confirmation, and research chemical sourcing review.
Research use context
This compound is intended for research use only (RUO) as a chemical building block. It is primarily used in Suzuki-Miyaura cross-coupling reactions for the synthesis of pyridine-containing organic molecules in academic and industrial research settings.
Documentation needs
Handle 5-Bromo-6-(trifluoromethyl)pyridin-3-ylboronic acid in a well-ventilated area or fume hood. Wear appropriate personal protective equipment, including safety goggles, gloves, and a lab coat. Avoid inhalation, ingestion, and skin contact.
For supplier-issued SDS, request documentation before handling, storage, shipment, or procurement decisions.
Preliminary Safety Reference
For supplier-issued SDS or COA, submit a documentation request.
Safety Reference / SDS Request