Research chemical
CAS Number: 2666994-25-6
![(11aS)-3,7-Bis(3,5-dichlorophenyl)-10,11,12,13-tetrahydro-5-hydroxy-5-oxide-diindeno[7,1-de:1',7'-fg][1,3,2]dioxaphosphocin molecular structure, CAS 2666994-25-6](/structure-images/2666994-25-6.png?v=struct-v3)
Product details
For laboratory research and professional procurement workflows.
PubChem CID
146680030
Exact Mass
603.974557
InChIKey
CSYNMLYRUQUBRH-UHFFFAOYSA-N
IUPAC Name
1,10-bis(3,5-dichlorophenyl)-12-hydroxy-4,5,6,7-tetrahydroiindeno[7,1-de:1',7'-fg][1,3,2]dioxaphosphocine 12-oxide
SMILES String
O=P1(O)Oc2c(-c3cc(Cl)cc(Cl)c3)ccc3c2C2(CC3)CCc3ccc(-c4cc(Cl)cc(Cl)c4)c(c32)O1
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.
(11aS)-3,7-Bis(3,5-dichlorophenyl)-10,11,12,13-tetrahydro-5-hydroxy-5-oxide-diindeno[7,1-de:1',7'-fg][1,3,2]dioxaphosphocin is identified by CAS 2666994-25-6, with molecular formula C29H19Cl4O4P, molecular weight 604.2, InChIKey CSYNMLYRUQUBRH-UHFFFAOYSA-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
38
H-bond acceptors
4
H-bond donors
1
Rotatable bonds
2
Ring count
7
Aromatic rings
4
Topological polar surface area
55.76 Ų
Computed LogP
9.68
Fragment-like structure rule
No
Lead-like structure rule
No
Drug-like structure rule
No
Structure family
organophosphorus reagent
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
(11aS)-3,7-Bis(3,5-dichlorophenyl)-10,11,12,13-tetrahydro-5-hydroxy-5-oxide-diindeno[7,1-de:1',7'-fg][1,3,2]dioxaphosphocin (CAS 2666994-25-6) is maintained as a commercial cas reference with formula C29H19Cl4O4P, molecular weight 604.
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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Submit the CAS number, quantity, purity requirement, and destination country for sourcing review.