(4-Chlorophenyl)-dimethyl-sulfonium; methyl hydrogen sulfate
TL;DR: (4-Chlorophenyl)-dimethyl-sulfonium; methyl hydrogen sulfate (CAS 14734-51-1) is a chemical compound with molecular formula C9H14ClO4S2+ and molecular weight 285.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-chlorophenyl)-dimethylsulfanium;methyl hydrogen sulfate
Also Known As: (4-chlorophenyl)-dimethyl-sulfonium; methyl hydrogen sulfate, (4-chlorophenyl)-dimethylsulfanium; methyl hydrogen sulfate, Methyl hydrogen sulfate compound with 1-chloro-4-(dimethyl-lambda(4)-sulfanyl)benzene (1:1), Methyl hydrogen sulfate compound with 1-chloro-4-(dimethyl-lambda~4~-sulfanyl)benzene (1:1)
| Molecular Formula | C9H14ClO4S2+ |
|---|---|
| Molecular Weight | 285.00 g/mol |
| LogP | 2.0124 |
| Topological Polar Surface Area | 73.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 285.0022 |
| Heavy Atoms | 16 |
| Complexity | 199.0 |
Chemical Identifiers
| CAS Number | 14734-51-1 |
|---|---|
| SMILES | COS(=O)(=O)O.C[S+](C)C1=CC=C(C=C1)Cl |
| InChIKey | ZDFSHBGTAHUHQP-UHFFFAOYSA-N |
Product Overview
(4-Chlorophenyl)-dimethyl-sulfonium; methyl hydrogen sulfate (CAS 14734-51-1), with molecular formula C9H14ClO4S2+ and molecular weight 285.00 g/mol. IUPAC: (4-chlorophenyl)-dimethylsulfanium;methyl hydrogen sulfate.
Chemical Property Profile of (4-Chlorophenyl)-dimethyl-sulfonium; methyl hydrogen sulfate
Property Insights of (4-Chlorophenyl)-dimethyl-sulfonium; methyl hydrogen sulfate
The XLogP value of 2.0124 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (4-Chlorophenyl)-dimethyl-sulfonium; methyl hydrogen sulfate. The TPSA of 73.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (4-Chlorophenyl)-dimethyl-sulfonium; methyl hydrogen sulfate. Following Lipinski's Rule of Five, (4-Chlorophenyl)-dimethyl-sulfonium; methyl hydrogen sulfate has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (4-Chlorophenyl)-dimethyl-sulfonium; methyl hydrogen sulfate?
The CAS number of (4-Chlorophenyl)-dimethyl-sulfonium; methyl hydrogen sulfate is 14734-51-1.
What is the molecular formula of (4-Chlorophenyl)-dimethyl-sulfonium; methyl hydrogen sulfate?
The molecular formula of (4-Chlorophenyl)-dimethyl-sulfonium; methyl hydrogen sulfate is C9H14ClO4S2+.
What is the molecular weight of (4-Chlorophenyl)-dimethyl-sulfonium; methyl hydrogen sulfate?
The molecular weight of (4-Chlorophenyl)-dimethyl-sulfonium; methyl hydrogen sulfate is 285.00 g/mol.
Where can I buy (4-Chlorophenyl)-dimethyl-sulfonium; methyl hydrogen sulfate?
You can request a quote for (4-Chlorophenyl)-dimethyl-sulfonium; methyl hydrogen sulfate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-Chlorophenyl)-dimethyl-sulfonium; methyl hydrogen sulfate?
Yes, KEHONG BIO provides custom synthesis services for (4-Chlorophenyl)-dimethyl-sulfonium; methyl hydrogen sulfate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.