2-Chloro-5-(dimethylsulfamoyl)benzoate
TL;DR: 2-Chloro-5-(dimethylsulfamoyl)benzoate (CAS 37088-27-0) is a chemical compound with molecular formula C9H9ClNO4S- and molecular weight 261.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-5-(dimethylsulfamoyl)benzoate
Also Known As: 2-chloro-5-(dimethylsulfamoyl)benzoate
| Molecular Formula | C9H9ClNO4S- |
|---|---|
| Molecular Weight | 261.99 g/mol |
| LogP | -0.0462 |
| Topological Polar Surface Area | 77.51 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 261.99408 |
| Heavy Atoms | 16 |
| Complexity | 524.31055 |
Chemical Identifiers
| CAS Number | 37088-27-0 |
|---|---|
| SMILES | CN(C)S(=O)(=O)C1=CC(=C(C=C1)Cl)C(=O)[O-] |
Product Overview
2-Chloro-5-(dimethylsulfamoyl)benzoate (CAS 37088-27-0), with molecular formula C9H9ClNO4S- and molecular weight 261.99 g/mol. IUPAC: 2-chloro-5-(dimethylsulfamoyl)benzoate.
Chemical Property Profile of 2-Chloro-5-(dimethylsulfamoyl)benzoate
Property Insights of 2-Chloro-5-(dimethylsulfamoyl)benzoate
The XLogP value of -0.0462 indicates that 2-Chloro-5-(dimethylsulfamoyl)benzoate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 77.51 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Chloro-5-(dimethylsulfamoyl)benzoate. Following Lipinski's Rule of Five, 2-Chloro-5-(dimethylsulfamoyl)benzoate has 0 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 2-Chloro-5-(dimethylsulfamoyl)benzoate?
The CAS number of 2-Chloro-5-(dimethylsulfamoyl)benzoate is 37088-27-0.
What is the molecular formula of 2-Chloro-5-(dimethylsulfamoyl)benzoate?
The molecular formula of 2-Chloro-5-(dimethylsulfamoyl)benzoate is C9H9ClNO4S-.
What is the molecular weight of 2-Chloro-5-(dimethylsulfamoyl)benzoate?
The molecular weight of 2-Chloro-5-(dimethylsulfamoyl)benzoate is 261.99 g/mol.
Where can I buy 2-Chloro-5-(dimethylsulfamoyl)benzoate?
You can request a quote for 2-Chloro-5-(dimethylsulfamoyl)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chloro-5-(dimethylsulfamoyl)benzoate?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloro-5-(dimethylsulfamoyl)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.