Research chemical
CAS Number: 83104-86-3
Product details
For laboratory research and professional procurement workflows.
PubChem CID
467296
Exact Mass
456.105647
InChIKey
XGTBMCGGGJLOPS-IFMALSPDSA-N
IUPAC Name
[(2R,3R)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2H-chromen-3-yl] 3,4-dihydroxy-5-methoxybenzoate
SMILES String
COC1=CC(=CC(=C1O)O)C(=O)O[C@@H]2CC3=C(C=C(C=C3O[C@@H]2C4=CC(=C(C=C4)O)O)O)O
No physical property values available.
Catalog navigation
Linked by recorded structural or research relationships, not interchangeable products. Check the exact CAS, specification and availability on the linked product page.
Epicatechin 3-O-(3-O-methylgallate) is identified by CAS 83104-86-3, with molecular formula C23H20O10, molecular weight 456.4, InChIKey XGTBMCGGGJLOPS-IFMALSPDSA-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.
Properties are provided as catalog reference data and may be confirmed through supplier documentation when required.
Heavy atom count
33
H-bond acceptors
10
H-bond donors
6
Rotatable bonds
4
Ring count
4
Aromatic rings
3
Topological polar surface area
166.14 Ų
Computed LogP
2.83
Fragment-like structure rule
No
Lead-like structure rule
No
Drug-like structure rule
No
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
Epicatechin 3-O-(3-O-methylgallate) (CAS 83104-86-3) is maintained as a commercial cas reference with formula C23H20O10, molecular weight 456. 40 g/mol, PubChem CID 467296.
Sourcing context
Catalog reference for RFQ preparation, supplier confirmation, and research chemical sourcing review.
Research use context
Use this page for CAS identity lookup, internal catalog search, and commercial discovery workflows.
Documentation needs
Review supplier documentation 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.