5-Acetamido-2-methylbenzenesulphonyl chloride
TL;DR: 5-Acetamido-2-methylbenzenesulphonyl chloride (CAS 13632-07-0) is a chemical compound with molecular formula C9H10ClNO3S and molecular weight 247.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-acetamido-2-methylbenzenesulfonyl chloride
Also Known As: 5-acetamido-2-methylbenzenesulfonyl chloride, 5-Acetamido-2-methylbenzene-1-sulfonyl chloride, 5-Acetamido-2-methylbenzenesulphonyl chloride, 5-(acetylamino)-2-methylbenzenesulfonyl chloride, 5-Acetylamino-2-methyl-benzenesulfonyl chloride
| Molecular Formula | C9H10ClNO3S |
|---|---|
| Molecular Weight | 247.01 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 71.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 247.00699 |
| Heavy Atoms | 15 |
| Complexity | 336.0 |
Chemical Identifiers
| CAS Number | 13632-07-0 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)NC(=O)C)S(=O)(=O)Cl |
| InChIKey | BCGUUSFEJVCVLK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-Acetamido-2-methylbenzenesulphonyl chloride (CAS 13632-07-0), with molecular formula C9H10ClNO3S and molecular weight 247.01 g/mol. IUPAC: 5-acetamido-2-methylbenzenesulfonyl chloride.
Chemical Property Profile of 5-Acetamido-2-methylbenzenesulphonyl chloride
Property Insights of 5-Acetamido-2-methylbenzenesulphonyl chloride
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Acetamido-2-methylbenzenesulphonyl chloride. The TPSA of 71.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Acetamido-2-methylbenzenesulphonyl chloride. Following Lipinski's Rule of Five, 5-Acetamido-2-methylbenzenesulphonyl chloride has 1 hydrogen bond donor(s) and 3 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 5-Acetamido-2-methylbenzenesulphonyl chloride?
The CAS number of 5-Acetamido-2-methylbenzenesulphonyl chloride is 13632-07-0.
What is the molecular formula of 5-Acetamido-2-methylbenzenesulphonyl chloride?
The molecular formula of 5-Acetamido-2-methylbenzenesulphonyl chloride is C9H10ClNO3S.
What is the molecular weight of 5-Acetamido-2-methylbenzenesulphonyl chloride?
The molecular weight of 5-Acetamido-2-methylbenzenesulphonyl chloride is 247.01 g/mol.
Where can I buy 5-Acetamido-2-methylbenzenesulphonyl chloride?
You can request a quote for 5-Acetamido-2-methylbenzenesulphonyl chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Acetamido-2-methylbenzenesulphonyl chloride?
Yes, KEHONG BIO provides custom synthesis services for 5-Acetamido-2-methylbenzenesulphonyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.