3-(2-Chloroethanesulfonyl)propanoic acid
TL;DR: 3-(2-Chloroethanesulfonyl)propanoic acid (CAS 3884-76-2) is a chemical compound with molecular formula C5H9ClO4S and molecular weight 199.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-chloroethylsulfonyl)propanoic acid
Also Known As: 3-(2-chloroethanesulfonyl)propanoic acid, starbld0040406, 3-(2-chloroethylsulfonyl)propanoic Acid, 3-((2-chloroethyl)sulfonyl)propanoic acid, 3-(2-chloroethylsulphonyl)-propionic acid
| Molecular Formula | C5H9ClO4S |
|---|---|
| Molecular Weight | 199.99 g/mol |
| LogP | 0.1147 |
| Topological Polar Surface Area | 71.44 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 199.99101 |
| Heavy Atoms | 11 |
| Complexity | 220.63692 |
Chemical Identifiers
| CAS Number | 3884-76-2 |
|---|---|
| SMILES | C(CS(=O)(=O)CCCl)C(=O)O |
Product Overview
3-(2-Chloroethanesulfonyl)propanoic acid (CAS 3884-76-2), with molecular formula C5H9ClO4S and molecular weight 199.99 g/mol. IUPAC: 3-(2-chloroethylsulfonyl)propanoic acid.
Chemical Property Profile of 3-(2-Chloroethanesulfonyl)propanoic acid
Property Insights of 3-(2-Chloroethanesulfonyl)propanoic acid
The XLogP value of 0.1147 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(2-Chloroethanesulfonyl)propanoic acid. The TPSA of 71.44 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(2-Chloroethanesulfonyl)propanoic acid. Following Lipinski's Rule of Five, 3-(2-Chloroethanesulfonyl)propanoic acid 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 3-(2-Chloroethanesulfonyl)propanoic acid?
The CAS number of 3-(2-Chloroethanesulfonyl)propanoic acid is 3884-76-2.
What is the molecular formula of 3-(2-Chloroethanesulfonyl)propanoic acid?
The molecular formula of 3-(2-Chloroethanesulfonyl)propanoic acid is C5H9ClO4S.
What is the molecular weight of 3-(2-Chloroethanesulfonyl)propanoic acid?
The molecular weight of 3-(2-Chloroethanesulfonyl)propanoic acid is 199.99 g/mol.
Where can I buy 3-(2-Chloroethanesulfonyl)propanoic acid?
You can request a quote for 3-(2-Chloroethanesulfonyl)propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2-Chloroethanesulfonyl)propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-Chloroethanesulfonyl)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.