Research chemical
CAS Number: 528521-85-9
![(S)-(7'-(Bis(3,5-dimethylphenyl)phosphanyl)-2,2',3,3'-tetrahydro-1,1'-spirobi[inden]-7-yl)bis(3,5-dimethylphenyl)phosphine oxide molecular structure, CAS 528521-85-9](/structure-images/528521-85-9.png?v=struct-v3)
Product details
For laboratory research and professional procurement workflows.
PubChem CID
170897824
Exact Mass
716.33369
InChIKey
ZAQVAUFRFBAVHF-GGCSAXROSA-N
IUPAC Name
[(3S)-4'-bis(3,5-dimethylphenyl)phosphoryl-3,3'-spirobi[1,2-dihydroindene]-4-yl]-bis(3,5-dimethylphenyl)phosphane
SMILES String
Cc1cc(C)cc(P(c2cc(C)cc(C)c2)c2cccc3c2[C@]2(CC3)CCc3cccc(P(=O)(c4cc(C)cc(C)c4)c4cc(C)cc(C)c4)c32)c1
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.
(S)-(7'-(Bis(3,5-dimethylphenyl)phosphanyl)-2,2',3,3'-tetrahydro-1,1'-spirobi[inden]-7-yl)bis(3,5-dimethylphenyl)phosphine oxide is identified by CAS 528521-85-9, with molecular formula C49H50OP2, molecular weight 716.9, InChIKey ZAQVAUFRFBAVHF-GGCSAXROSA-N.
Yes. Submit an RFQ and specify COA requirements. Lot-specific COA depends on supplier confirmation.
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Availability, pack size, lead time, and pricing are confirmed through RFQ.
Properties are provided as catalog reference data and may be confirmed through supplier documentation when required.
Heavy atom count
52
H-bond acceptors
1
H-bond donors
0
Rotatable bonds
6
Ring count
8
Aromatic rings
6
Topological polar surface area
17.07 Ų
Computed LogP
9.73
Fragment-like structure rule
No
Lead-like structure rule
No
Drug-like structure rule
No
Structure family
phosphine ligand
Precious metal motif
No
Transition metal motif
No
Phosphine ligand motif
Yes
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
(S)-(7'-(Bis(3,5-dimethylphenyl)phosphanyl)-2,2',3,3'-tetrahydro-1,1'-spirobi[inden]-7-yl)bis(3,5-dimethylphenyl)phosphine oxide (CAS 528521-85-9) is maintained as a commercial cas reference with formula C49H50OP2, molecular weight 716.
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; structure-derived tags include phosphine-ligand motif.
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.
Submit the CAS number, quantity, purity requirement, and destination country for sourcing review.