Sulfanediylbis-4,6-dichlorobenzene-2,1-diyl diacetate
TL;DR: Sulfanediylbis-4,6-dichlorobenzene-2,1-diyl diacetate (CAS 57548-01-3) is a chemical compound with molecular formula C16H10Cl4O4S and molecular weight 437.91 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(2-acetyloxy-3,5-dichlorophenyl)sulfanyl-4,6-dichlorophenyl] acetate
Also Known As: AB01331909-02, sulfanediylbis-4,6-dichlorobenzene-2,1-diyl diacetate, Phenol, 2,2a(2)-thiobis[4,6-dichloro-, diacetate, Sulfanediylbis(4,6-dichloro-2,1-phenylene) diacetate, [2-(2-acetyloxy-3,5-dichlorophenyl)sulfanyl-4,6-dichlorophenyl] acetate
| Molecular Formula | C16H10Cl4O4S |
|---|---|
| Molecular Weight | 437.91 g/mol |
| LogP | 6.302 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 437.9054 |
| Heavy Atoms | 25 |
| Complexity | 785.01373 |
Chemical Identifiers
| CAS Number | 57548-01-3 |
|---|---|
| SMILES | CC(=O)OC1=C(C=C(C=C1Cl)Cl)SC2=C(C(=CC(=C2)Cl)Cl)OC(=O)C |
Product Overview
Sulfanediylbis-4,6-dichlorobenzene-2,1-diyl diacetate (CAS 57548-01-3), with molecular formula C16H10Cl4O4S and molecular weight 437.91 g/mol. IUPAC: [2-(2-acetyloxy-3,5-dichlorophenyl)sulfanyl-4,6-dichlorophenyl] acetate.
Chemical Property Profile of Sulfanediylbis-4,6-dichlorobenzene-2,1-diyl diacetate
Property Insights of Sulfanediylbis-4,6-dichlorobenzene-2,1-diyl diacetate
The XLogP value of 6.302 indicates that Sulfanediylbis-4,6-dichlorobenzene-2,1-diyl diacetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, Sulfanediylbis-4,6-dichlorobenzene-2,1-diyl diacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Sulfanediylbis-4,6-dichlorobenzene-2,1-diyl diacetate has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Sulfanediylbis-4,6-dichlorobenzene-2,1-diyl diacetate?
The CAS number of Sulfanediylbis-4,6-dichlorobenzene-2,1-diyl diacetate is 57548-01-3.
What is the molecular formula of Sulfanediylbis-4,6-dichlorobenzene-2,1-diyl diacetate?
The molecular formula of Sulfanediylbis-4,6-dichlorobenzene-2,1-diyl diacetate is C16H10Cl4O4S.
What is the molecular weight of Sulfanediylbis-4,6-dichlorobenzene-2,1-diyl diacetate?
The molecular weight of Sulfanediylbis-4,6-dichlorobenzene-2,1-diyl diacetate is 437.91 g/mol.
Where can I buy Sulfanediylbis-4,6-dichlorobenzene-2,1-diyl diacetate?
You can request a quote for Sulfanediylbis-4,6-dichlorobenzene-2,1-diyl diacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Sulfanediylbis-4,6-dichlorobenzene-2,1-diyl diacetate?
Yes, KEHONG BIO provides custom synthesis services for Sulfanediylbis-4,6-dichlorobenzene-2,1-diyl diacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.