Research chemical
CAS Number: 2225152-80-5
Product details
For laboratory research and professional procurement workflows.
PubChem CID
133555283
Exact Mass
273.114793
InChIKey
YXRKPUNTORJIAJ-UHFFFAOYSA-N
IUPAC Name
[5-piperidin-3-yl-2-(trifluoromethyl)phenyl]boronic acid
SMILES String
OB(O)c1cc(C2CCCNC2)ccc1C(F)(F)F
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.
2-Trifluoromethyl-5-(piperidin-3-yl)phenylboronic acid is identified by CAS 2225152-80-5, with molecular formula C12H15BF3NO2, molecular weight 273.06, InChIKey YXRKPUNTORJIAJ-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 solid
Physical State
Solid
Melting Point
155.0 °C
Boiling Point
380.0 °C
Density
1.35 g/cm³
Water Solubility
Slightly soluble
Flash Point
200.0 °C
Vapor Pressure
Estimated very low; 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
19
H-bond acceptors
3
H-bond donors
3
Rotatable bonds
2
Ring count
2
Aromatic rings
1
Topological polar surface area
52.49 Ų
Computed LogP
0.85
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 functionalized phenylboronic acid derivative featuring a trifluoromethyl group and a piperidin-3-yl substituent.
Sourcing context
Catalog reference for RFQ preparation, supplier confirmation, and research chemical sourcing review.
Research use context
Primarily used as a versatile building block in organic synthesis, particularly in Suzuki-Miyaura cross-coupling reactions, for the creation of novel pharmaceutical intermediates, agrochemicals, and advanced materials in research and development settings.
Documentation needs
Handle with appropriate personal protective equipment, including gloves, eye protection, and a lab coat. Use in a well-ventilated area or under a fume hood to avoid inhalation. 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