Research chemical
CAS Number: 344782-49-6
Product details
For laboratory research and professional procurement workflows.
PubChem CID
71463996
Exact Mass
590.395
InChIKey
YEMRKPSPAXPCOJ-UHFFFAOYSA-N
IUPAC Name
2-[7-(1,3,2-dioxaborinan-2-yloxy)-9,9-bis(2-ethylhexyl)fluoren-2-yl]oxy-1,3,2-dioxaborinane
SMILES String
B1(OCCCO1)OC2=CC3=C(C=C2)C4=C(C3(CC(CC)CCCC)CC(CC)CCCC)C=C(C=C4)OB5OCCCO5
No physical property values available.
Properties are provided as catalog reference data and may be confirmed through supplier documentation when required.
2,2'-((9,9-Bis(2-ethylhexyl)-9H-fluorene-2,7-diyl)bis(oxy))bis(1,3,2-dioxaborinane) is identified by CAS 344782-49-6, with molecular formula C35H52B2O6, molecular weight 590.4, InChIKey YEMRKPSPAXPCOJ-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.
Heavy atom count
43
H-bond acceptors
6
H-bond donors
0
Rotatable bonds
16
Ring count
5
Aromatic rings
2
Topological polar surface area
55.38 Ų
Computed LogP
8.77
Fragment-like structure rule
No
Lead-like structure rule
No
Drug-like structure rule
No
Structure family
boronic acid or boronate
Precious metal motif
No
Transition metal motif
No
Phosphine ligand motif
No
N-heterocycle motif
No
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
2,2'-((9,9-Bis(2-ethylhexyl)-9H-fluorene-2,7-diyl)bis(oxy))bis(1,3,2-dioxaborinane) (CAS 344782-49-6) is listed in the Advanced Chemicals portfolio, with molecular formula C35H52B2O6 and molecular weight 590. 40 g/mol.
Sourcing context
Catalog reference for RFQ preparation, supplier confirmation, and research chemical sourcing review.
Research use context
Intended for research building-block and synthetic chemistry workflows; structure-derived tags include boronic-acid-related structure.
Documentation needs
Consult the supplier SDS before handling; For research use only.
Safety and handling reference content is available through documentation requests.
For supplier-issued SDS, request documentation before handling, storage, shipment, or procurement decisions.