Research chemical
CAS Number: 331248-11-4
![7-[3,5-Di-tert-butyl-2-(2,2-difluoroethoxy)phenyl]-3-methylocta-2,4,6-trienoic acid molecular structure, CAS 331248-11-4](/structure-images/331248-11-4.png?v=struct-v2)
Product details
For laboratory research and professional procurement workflows.
PubChem CID
71433850
Exact Mass
420.247601
InChIKey
BHIBZAZKKARFIM-UHFFFAOYSA-N
IUPAC Name
7-[3,5-ditert-butyl-2-(2,2-difluoroethoxy)phenyl]-3-methylocta-2,4,6-trienoic acid
SMILES String
CC(C=CC=C(C)c1cc(C(C)(C)C)cc(C(C)(C)C)c1OCC(F)F)=CC(=O)O
No physical property values available.
Properties are provided as catalog reference data and may be confirmed through supplier documentation when required.
Catalog navigation
Linked by recorded structural or research relationships, not interchangeable products. Check the exact CAS, specification and availability on the linked product page.
7-[3,5-Di-tert-butyl-2-(2,2-difluoroethoxy)phenyl]-3-methylocta-2,4,6-trienoic acid is identified by CAS 331248-11-4, with molecular formula C25H34F2O3, molecular weight 420.5, InChIKey BHIBZAZKKARFIM-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.
Heavy atom count
30
H-bond acceptors
3
H-bond donors
1
Rotatable bonds
7
Ring count
1
Aromatic rings
1
Topological polar surface area
46.53 Ų
Computed LogP
6.92
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
7-[3,5-Di-tert-butyl-2-(2,2-difluoroethoxy)phenyl]-3-methylocta-2,4,6-trienoic acid (CAS 331248-11-4) is maintained as a commercial cas reference with formula C25H34F2O3, molecular weight 420. 50 g/mol, PubChem CID 71433850.
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.