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Ethyl 3-[(4-bromophenyl)sulfonyl]propanoate
TL;DR: Ethyl 3-[(4-bromophenyl)sulfonyl]propanoate (CAS 14223-25-7) is a chemical compound with molecular formula C11H13BrO4S and molecular weight 319.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-(4-bromophenyl)sulfonylpropanoate
Also Known As: ethyl 3-[(4-bromophenyl)sulfonyl]propanoate, ethyl 3-(4-bromophenyl)sulfonylpropanoate, BAS 00127305, Ethyl 3-(4-bromobenzene-1-sulfonyl)propanoate, 3-(4-Bromo-benzenesulfonyl)-propionic acid ethyl ester
| Molecular Formula | C11H13BrO4S |
|---|---|
| Molecular Weight | 319.97 g/mol |
| LogP | 2.176 |
| Topological Polar Surface Area | 60.44 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 319.9718 |
| Heavy Atoms | 17 |
| Complexity | 478.6978 |
Chemical Identifiers
| CAS Number | 14223-25-7 |
|---|---|
| SMILES | CCOC(=O)CCS(=O)(=O)C1=CC=C(C=C1)Br |
Product Overview
Ethyl 3-[(4-bromophenyl)sulfonyl]propanoate (CAS 14223-25-7), with molecular formula C11H13BrO4S and molecular weight 319.97 g/mol. IUPAC: ethyl 3-(4-bromophenyl)sulfonylpropanoate.
Chemical Property Profile of Ethyl 3-[(4-bromophenyl)sulfonyl]propanoate
Property Insights of Ethyl 3-[(4-bromophenyl)sulfonyl]propanoate
The XLogP value of 2.176 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 3-[(4-bromophenyl)sulfonyl]propanoate. The TPSA of 60.44 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 3-[(4-bromophenyl)sulfonyl]propanoate. Following Lipinski's Rule of Five, Ethyl 3-[(4-bromophenyl)sulfonyl]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-[(4-bromophenyl)sulfonyl]propanoate?
The CAS number of Ethyl 3-[(4-bromophenyl)sulfonyl]propanoate is 14223-25-7.
What is the molecular formula of Ethyl 3-[(4-bromophenyl)sulfonyl]propanoate?
The molecular formula of Ethyl 3-[(4-bromophenyl)sulfonyl]propanoate is C11H13BrO4S.
What is the molecular weight of Ethyl 3-[(4-bromophenyl)sulfonyl]propanoate?
The molecular weight of Ethyl 3-[(4-bromophenyl)sulfonyl]propanoate is 319.97 g/mol.
Where can I buy Ethyl 3-[(4-bromophenyl)sulfonyl]propanoate?
You can request a quote for Ethyl 3-[(4-bromophenyl)sulfonyl]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-[(4-bromophenyl)sulfonyl]propanoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 3-[(4-bromophenyl)sulfonyl]propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.