(2,6-Dichlorophenyl)methanesulfonyl chloride
TL;DR: (2,6-Dichlorophenyl)methanesulfonyl chloride (CAS 85952-31-4) is a chemical compound with molecular formula C7H5Cl3O2S and molecular weight 257.91 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,6-dichlorophenyl)methanesulfonyl chloride
Also Known As: (2,6-Dichlorophenyl)methanesulfonyl chloride, 2,6-Dichlorobenzylsulfonyl chloride, Benzenemethanesulfonyl chloride, 2,6-dichloro-, 2,6-dichlorobenzylsulfonylchloride, (2,6-Dichlorophenyl)methanesulphonyl chloride
| Molecular Formula | C7H5Cl3O2S |
|---|---|
| Molecular Weight | 257.91 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 42.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 257.9076 |
| Heavy Atoms | 13 |
| Complexity | 249.0 |
Chemical Identifiers
| CAS Number | 85952-31-4 |
|---|---|
| SMILES | C1=CC(=C(C(=C1)Cl)CS(=O)(=O)Cl)Cl |
| InChIKey | JAIDEMJIMSTEKX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(2,6-Dichlorophenyl)methanesulfonyl chloride (CAS 85952-31-4), with molecular formula C7H5Cl3O2S and molecular weight 257.91 g/mol. IUPAC: (2,6-dichlorophenyl)methanesulfonyl chloride.
Chemical Property Profile of (2,6-Dichlorophenyl)methanesulfonyl chloride
Property Insights of (2,6-Dichlorophenyl)methanesulfonyl chloride
The XLogP value of 3.1 indicates that (2,6-Dichlorophenyl)methanesulfonyl chloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.5 Ų, (2,6-Dichlorophenyl)methanesulfonyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2,6-Dichlorophenyl)methanesulfonyl chloride has 0 hydrogen bond donor(s) and 2 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 (2,6-Dichlorophenyl)methanesulfonyl chloride?
The CAS number of (2,6-Dichlorophenyl)methanesulfonyl chloride is 85952-31-4.
What is the molecular formula of (2,6-Dichlorophenyl)methanesulfonyl chloride?
The molecular formula of (2,6-Dichlorophenyl)methanesulfonyl chloride is C7H5Cl3O2S.
What is the molecular weight of (2,6-Dichlorophenyl)methanesulfonyl chloride?
The molecular weight of (2,6-Dichlorophenyl)methanesulfonyl chloride is 257.91 g/mol.
Where can I buy (2,6-Dichlorophenyl)methanesulfonyl chloride?
You can request a quote for (2,6-Dichlorophenyl)methanesulfonyl chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2,6-Dichlorophenyl)methanesulfonyl chloride?
Yes, KEHONG BIO provides custom synthesis services for (2,6-Dichlorophenyl)methanesulfonyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.