Research chemical
CAS Number: 2687968-84-7
![(R)-8,8'-Bis(3,5-bis(trifluoromethyl)phenyl)-2,2',3,3'-tetrahydro-1,1'-spirobi[phenalene]-9,9'-diol molecular structure, CAS 2687968-84-7](/structure-images/2687968-84-7.png?v=struct-v3)
Product details
For laboratory research and professional procurement workflows.
PubChem CID
169545553
Exact Mass
776.158468
InChIKey
JDXZMVXPEFYHSQ-UHFFFAOYSA-N
IUPAC Name
2,2'-bis[3,5-bis(trifluoromethyl)phenyl]-9,9'-spirobi[7,8-dihydrophenalene]-1,1'-diol
SMILES String
Oc1c(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)cc2cccc3c2c1C1(CC3)CCc2cccc3cc(-c4cc(C(F)(F)F)cc(C(F)(F)F)c4)c(O)c1c23
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.
(R)-8,8'-Bis(3,5-bis(trifluoromethyl)phenyl)-2,2',3,3'-tetrahydro-1,1'-spirobi[phenalene]-9,9'-diol is identified by CAS 2687968-84-7, with molecular formula C41H24F12O2, molecular weight 776.6, InChIKey JDXZMVXPEFYHSQ-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
55
H-bond acceptors
2
H-bond donors
2
Rotatable bonds
2
Ring count
8
Aromatic rings
6
Topological polar surface area
40.46 Ų
Computed LogP
12.99
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
(R)-8,8'-Bis(3,5-bis(trifluoromethyl)phenyl)-2,2',3,3'-tetrahydro-1,1'-spirobi[phenalene]-9,9'-diol (CAS 2687968-84-7) is maintained as a commercial cas reference with formula C41H24F12O2, molecular weight 776. 60 g/mol, PubChem CID 169545553.
Sourcing context
Catalog reference for RFQ preparation, supplier confirmation, and research chemical sourcing review.
Research use context
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Documentation needs
Review supplier documentation before handling; for research use only.
Safety and handling reference content is available through documentation requests.
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