Ethyl 3-(chlorosulfonyl)propanoate
TL;DR: Ethyl 3-(chlorosulfonyl)propanoate (CAS 103472-25-9) 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.
ethyl 3-chlorosulfonylpropanoate
Also Known As: ethyl 3-(chlorosulfonyl)propanoate, Ethyl 3-chlorosulfonylpropanoate, ethyl 3-sulfopropanoate, ethyl 3-(chlorosulfonyl)propionate, ethyl 3-chlorosulphonylpropanoate
| Molecular Formula | C5H9ClO4S |
|---|---|
| Molecular Weight | 199.99 g/mol |
| LogP | 0.5082 |
| Topological Polar Surface Area | 60.44 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 199.99101 |
| Heavy Atoms | 11 |
| Complexity | 220.63692 |
Chemical Identifiers
| CAS Number | 103472-25-9 |
|---|---|
| SMILES | CCOC(=O)CCS(=O)(=O)Cl |
Product Overview
Ethyl 3-(chlorosulfonyl)propanoate (CAS 103472-25-9), with molecular formula C5H9ClO4S and molecular weight 199.99 g/mol. IUPAC: ethyl 3-chlorosulfonylpropanoate.
Chemical Property Profile of Ethyl 3-(chlorosulfonyl)propanoate
Property Insights of Ethyl 3-(chlorosulfonyl)propanoate
The XLogP value of 0.5082 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 3-(chlorosulfonyl)propanoate. The TPSA of 60.44 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 3-(chlorosulfonyl)propanoate. Following Lipinski's Rule of Five, Ethyl 3-(chlorosulfonyl)propanoate 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 Ethyl 3-(chlorosulfonyl)propanoate?
The CAS number of Ethyl 3-(chlorosulfonyl)propanoate is 103472-25-9.
What is the molecular formula of Ethyl 3-(chlorosulfonyl)propanoate?
The molecular formula of Ethyl 3-(chlorosulfonyl)propanoate is C5H9ClO4S.
What is the molecular weight of Ethyl 3-(chlorosulfonyl)propanoate?
The molecular weight of Ethyl 3-(chlorosulfonyl)propanoate is 199.99 g/mol.
Where can I buy Ethyl 3-(chlorosulfonyl)propanoate?
You can request a quote for Ethyl 3-(chlorosulfonyl)propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 3-(chlorosulfonyl)propanoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 3-(chlorosulfonyl)propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.