Research chemical
CAS Number: 1007346-44-2
![1-[3-Fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-YL)phenyl]-2-piperidinone molecular structure, CAS 1007346-44-2](/structure-images/1007346-44-2.png?v=struct-v2)
Product details
For laboratory research and professional procurement workflows.
PubChem CID
24774211
Exact Mass
319.175502
InChIKey
QLXCGGDOVAONQR-UHFFFAOYSA-N
IUPAC Name
1-[3-fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]piperidin-2-one
SMILES String
CC1(C)OB(c2ccc(N3CCCCC3=O)cc2F)OC1(C)C
No physical property values available.
Properties are provided as catalog reference data and may be confirmed through supplier documentation when required.
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.
1-[3-Fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-YL)phenyl]-2-piperidinone is identified by CAS 1007346-44-2, with molecular formula C17H23BFNO3, molecular weight 319.2, InChIKey QLXCGGDOVAONQR-UHFFFAOYSA-N.
Yes. Submit an RFQ and specify COA requirements. Lot-specific COA depends on supplier confirmation.
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Heavy atom count
23
H-bond acceptors
4
H-bond donors
0
Rotatable bonds
2
Ring count
3
Aromatic rings
1
Topological polar surface area
38.77 Ų
Computed LogP
2.64
Fragment-like structure rule
No
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
1-[3-Fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-YL)phenyl]-2-piperidinone (CAS 1007346-44-2) is an English MolGraph catalog reference, molecular formula C17H23BFNO3 and molecular weight 319. 20 g/mol.
Sourcing context
Catalog reference for RFQ preparation, supplier confirmation, and research chemical sourcing review.
Research use context
Use this page to review identity data, application tags, sourcing readiness, and RFQ context for boronic acid and ester chemistry, research chemical sourcing.
Documentation needs
Request supplier-issued SDS/COA before handling, storage, shipment, or procurement decisions. Public page content is for research catalog reference and does not replace supplier-issued safety documentation.
Safety and handling reference content is available through documentation requests.
For supplier-issued SDS, request documentation before handling, storage, shipment, or procurement decisions.