Research chemical
CAS Number: 2728426-49-9
![[4-(4-Chloro-2,5-dimethoxyphenyl)sulfonyloxy-3-methylphenyl] 4-chloro-2,5-dimethoxybenzenesulfonate molecular structure, CAS 2728426-49-9](/structure-images/2728426-49-9.png?v=struct-v3)
Product details
For laboratory research and professional procurement workflows.
PubChem CID
163343282
Exact Mass
592.003145
InChIKey
JBXDFBHFRYRBRC-UHFFFAOYSA-N
SMILES String
COc1cc(S(=O)(=O)Oc2ccc(OS(=O)(=O)c3cc(OC)c(Cl)cc3OC)c(C)c2)c(OC)cc1Cl
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.
[4-(4-Chloro-2,5-dimethoxyphenyl)sulfonyloxy-3-methylphenyl] 4-chloro-2,5-dimethoxybenzenesulfonate is identified by CAS 2728426-49-9, with molecular formula C23H22Cl2O10S2, molecular weight 593.5, InChIKey JBXDFBHFRYRBRC-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
37
H-bond acceptors
10
H-bond donors
0
Rotatable bonds
10
Ring count
3
Aromatic rings
3
Topological polar surface area
123.66 Ų
Computed LogP
4.87
Fragment-like structure rule
No
Lead-like structure rule
No
Drug-like structure rule
Yes
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
[4-(4-Chloro-2,5-dimethoxyphenyl)sulfonyloxy-3-methylphenyl] 4-chloro-2,5-dimethoxybenzenesulfonate (CAS 2728426-49-9) is maintained as a commercial cas reference with formula C23H22Cl2O10S2, molecular weight 593. 50 g/mol, PubChem CID 163343282.
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 drug-like rule profile.
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.