Research chemical
CAS Number: 1005163-93-8
![(1S,2S,4S)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-yl 6-methoxy-2-oxo-2H-chromene-3-carboxylate molecular structure, CAS 1005163-93-8](/structure-images/1005163-93-8.png?v=struct-v3)
Product details
For laboratory research and professional procurement workflows.
PubChem CID
2971889
Exact Mass
356.162374
InChIKey
DZBWSUUMDFCORR-UHFFFAOYSA-N
IUPAC Name
(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl) 6-methoxy-2-oxochromene-3-carboxylate
SMILES String
COc1ccc2oc(=O)c(C(=O)OC3CC4CCC3(C)C4(C)C)cc2c1
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.
(1S,2S,4S)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-yl 6-methoxy-2-oxo-2H-chromene-3-carboxylate is identified by CAS 1005163-93-8, with molecular formula C21H24O5, molecular weight 356.4, InChIKey DZBWSUUMDFCORR-UHFFFAOYSA-N.
Yes. Submit an RFQ and specify COA requirements. Lot-specific COA depends on supplier confirmation.
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Submit the CAS number, quantity, purity requirement, and destination country for sourcing review.
XLogP
4.9
Properties are provided as catalog reference data and may be confirmed through supplier documentation when required.
Heavy atom count
26
H-bond acceptors
5
H-bond donors
0
Rotatable bonds
3
Ring count
4
Aromatic rings
2
Topological polar surface area
65.74 Ų
Computed LogP
4.17
Fragment-like structure rule
No
Lead-like structure rule
No
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
(1S,2S,4S)-1,7,7-trimethylbicyclo[2. 2. 1]heptan-2-yl 6-methoxy-2-oxo-2H-chromene-3-carboxylate (CAS 1005163-93-8) is an English MolGraph catalog reference, molecular formula C21H24O5 and molecular weight 356. 40 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
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.