1-(4,5-Dibromo-2-thienyl)-1-ethanone
TL;DR: 1-(4,5-Dibromo-2-thienyl)-1-ethanone (CAS 7209-12-3) is a chemical compound with molecular formula C6H4Br2OS and molecular weight 281.83 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4,5-dibromothiophen-2-yl)ethanone
Also Known As: 1-(4,5-Dibromo-2-thienyl)-1-ethanone, 1-(4,5-dibromothiophen-2-yl)ethanone, 2-Acetyl-4,5-dibromothiophene, 5-Acetyl-2,3-dibromothiophene, 4,5-dibromo-2-acetylthiophene
| Molecular Formula | C6H4Br2OS |
|---|---|
| Molecular Weight | 281.83 g/mol |
| LogP | 3.4757 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 281.83496 |
| Heavy Atoms | 10 |
| Complexity | 247.21158 |
Chemical Identifiers
| CAS Number | 7209-12-3 |
|---|---|
| SMILES | CC(=O)C1=CC(=C(S1)Br)Br |
Product Overview
1-(4,5-Dibromo-2-thienyl)-1-ethanone (CAS 7209-12-3), with molecular formula C6H4Br2OS and molecular weight 281.83 g/mol. IUPAC: 1-(4,5-dibromothiophen-2-yl)ethanone.
Chemical Property Profile of 1-(4,5-Dibromo-2-thienyl)-1-ethanone
Property Insights of 1-(4,5-Dibromo-2-thienyl)-1-ethanone
The XLogP value of 3.4757 indicates that 1-(4,5-Dibromo-2-thienyl)-1-ethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.07 Ų, 1-(4,5-Dibromo-2-thienyl)-1-ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4,5-Dibromo-2-thienyl)-1-ethanone has 0 hydrogen bond donor(s) and 2 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 1-(4,5-Dibromo-2-thienyl)-1-ethanone?
The CAS number of 1-(4,5-Dibromo-2-thienyl)-1-ethanone is 7209-12-3.
What is the molecular formula of 1-(4,5-Dibromo-2-thienyl)-1-ethanone?
The molecular formula of 1-(4,5-Dibromo-2-thienyl)-1-ethanone is C6H4Br2OS.
What is the molecular weight of 1-(4,5-Dibromo-2-thienyl)-1-ethanone?
The molecular weight of 1-(4,5-Dibromo-2-thienyl)-1-ethanone is 281.83 g/mol.
Where can I buy 1-(4,5-Dibromo-2-thienyl)-1-ethanone?
You can request a quote for 1-(4,5-Dibromo-2-thienyl)-1-ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4,5-Dibromo-2-thienyl)-1-ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(4,5-Dibromo-2-thienyl)-1-ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.