Research chemical
CAS Number: 101068-29-5
Product details
For laboratory research and professional procurement workflows.
PubChem CID
764011
Exact Mass
302.079038
InChIKey
PKOYQBUAMKAMST-UHFFFAOYSA-N
SMILES String
O=C(Cc1ccc2c(c1)OCCO2)c1c(O)cc(O)cc1O
No physical property values available.
XLogP
2.4
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-(2,3-Dihydro-1,4-benzodioxin-6-yl)-1-(2,4,6-trihydroxyphenyl)ethanone is identified by CAS 101068-29-5, with molecular formula C16H14O6, molecular weight 302.28, InChIKey PKOYQBUAMKAMST-UHFFFAOYSA-N.
Yes. Submit an RFQ and specify COA requirements. Lot-specific COA depends on supplier confirmation.
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Properties are provided as catalog reference data and may be confirmed through supplier documentation when required.
Heavy atom count
22
H-bond acceptors
6
H-bond donors
3
Rotatable bonds
3
Ring count
3
Aromatic rings
2
Topological polar surface area
96.22 Ų
Computed LogP
2
Fragment-like structure rule
No
Lead-like structure rule
Yes
Drug-like structure rule
Yes
Structure family
other structure rule
Precious metal motif
No
Transition metal motif
No
Phosphine ligand motif
No
N-heterocycle motif
No
Boronic acid motif
No
Computed structure descriptors generated from molecular structure. These are not experimental physical property values, supplier specifications, SDS data, or bioactivity claims.
Structural features
2-(2,3-Dihydro-1,4-benzodioxin-6-yl)-1-(2,4,6-trihydroxyphenyl)ethanone (CAS 101068-29-5) is an English MolGraph catalog reference, molecular formula C16H14O6 and molecular weight 302. 28 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 catalysis and ligand research, research chemical sourcing.
Documentation needs
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Safety and handling reference content is available through documentation requests.
For supplier-issued SDS, request documentation before handling, storage, shipment, or procurement decisions.