Research chemical
CAS Number: 1706463-50-4
![(S)-2,6-Bis(3,5-dichlorophenyl)-4-hydroxydinaphtho-[2,1-d:1',2'-f][1,3,2]dioxaphosphepine 4-sulfide molecular structure, CAS 1706463-50-4](/structure-images/1706463-50-4.png?v=struct-v3)
Product details
For laboratory research and professional procurement workflows.
PubChem CID
99770953
Exact Mass
653.936063
InChIKey
WIBYKZHXRJDMBB-UHFFFAOYSA-N
IUPAC Name
10,16-bis(3,5-dichlorophenyl)-13-hydroxy-13-sulfanylidene-12,14-dioxa-13lambda5-phosphapentacyclo[13.8.0.02,11.03,8.018,23]tricosa-1(15),2(11),3,5,7,9,16,18,20,22-decaene
SMILES String
OP1(=S)Oc2c(-c3cc(Cl)cc(Cl)c3)cc3ccccc3c2-c2c(c(-c3cc(Cl)cc(Cl)c3)cc3ccccc23)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.
(S)-2,6-Bis(3,5-dichlorophenyl)-4-hydroxydinaphtho-[2,1-d:1',2'-f][1,3,2]dioxaphosphepine 4-sulfide is identified by CAS 1706463-50-4, with molecular formula C32H17Cl4O3PS, molecular weight 654.3, InChIKey WIBYKZHXRJDMBB-UHFFFAOYSA-N.
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Properties are provided as catalog reference data and may be confirmed through supplier documentation when required.
Heavy atom count
41
H-bond acceptors
3
H-bond donors
1
Rotatable bonds
2
Ring count
7
Aromatic rings
6
Topological polar surface area
38.69 Ų
Computed LogP
11.6
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
(S)-2,6-Bis(3,5-dichlorophenyl)-4-hydroxydinaphtho-[2,1-d:1',2'-f][1,3,2]dioxaphosphepine 4-sulfide (CAS 1706463-50-4) is maintained as a commercial cas reference with formula C32H17Cl4O3PS, molecular weight 654. 30 g/mol, PubChem CID 99770953.
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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