Ethyl bromopyruvate
TL;DR: Ethyl bromopyruvate (CAS 70-23-5) is a chemical compound with molecular formula C5H7BrO3 and molecular weight 193.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-bromo-2-oxopropanoate
Also Known As: Ethyl bromopyruvate, Ethyl 3-bromo-2-oxopropanoate, Ethyl 3-bromopyruvate, ethyl bromo pyruvate, 3-bromopyruvate
| Molecular Formula | C5H7BrO3 |
|---|---|
| Molecular Weight | 193.96 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 193.95786 |
| Heavy Atoms | 9 |
| Complexity | 121.0 |
Chemical Identifiers
| CAS Number | 70-23-5 |
|---|---|
| SMILES | CCOC(=O)C(=O)CBr |
| InChIKey | VICYTAYPKBLQFB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethyl bromopyruvate (CAS 70-23-5), with molecular formula C5H7BrO3 and molecular weight 193.96 g/mol. IUPAC: ethyl 3-bromo-2-oxopropanoate.
Chemical Property Profile of Ethyl bromopyruvate
Property Insights of Ethyl bromopyruvate
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl bromopyruvate. With a topological polar surface area (TPSA) of 43.4 Ų, Ethyl bromopyruvate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl bromopyruvate has 0 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 Ethyl bromopyruvate?
The CAS number of Ethyl bromopyruvate is 70-23-5.
What is the molecular formula of Ethyl bromopyruvate?
The molecular formula of Ethyl bromopyruvate is C5H7BrO3.
What is the molecular weight of Ethyl bromopyruvate?
The molecular weight of Ethyl bromopyruvate is 193.96 g/mol.
Where can I buy Ethyl bromopyruvate?
You can request a quote for Ethyl bromopyruvate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl bromopyruvate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl bromopyruvate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.