Research chemical
CAS Number: 2225170-30-7
Product details
For laboratory research and professional procurement workflows.
PubChem CID
72212867
Exact Mass
268.94706
InChIKey
MFJXNNZIXUYZKM-UHFFFAOYSA-N
IUPAC Name
[2-bromo-6-(trifluoromethyl)-4-pyridinyl]boronic acid
SMILES String
OB(O)c1cc(Br)nc(C(F)(F)F)c1
Appearance
Catalog navigation
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2-Bromo-6-(trifluoromethyl)pyridine-4-boronic acid is identified by CAS 2225170-30-7, with molecular formula C6H4BBrF3NO2, molecular weight 269.81, InChIKey MFJXNNZIXUYZKM-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 solid
Physical State
Solid
Melting Point
165.0 °C
Boiling Point
320.0 °C
Density
1.8 g/cm³
Water Solubility
Slightly soluble
Flash Point
200.0 °C
Vapor Pressure
Estimated value, unit not specified
Autoignition Temp
400.0 °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
This compound is a boronic acid derivative of a brominated and trifluoromethylated pyridine.
Sourcing context
Catalog reference for RFQ preparation, supplier confirmation, and research chemical sourcing review.
Research use context
This compound is primarily used in research and development as a chemical building block.
Documentation needs
Handle with appropriate personal protective equipment (PPE), including gloves, eye protection, and a lab coat. Work in a well-ventilated area or under a fume hood to avoid inhalation of dust or vapors. Avoid contact with skin and eyes.
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