1-(5-Nitro-1-benzofuran-2-YL)ethanone
TL;DR: 1-(5-Nitro-1-benzofuran-2-YL)ethanone (CAS 2792-72-5) is a chemical compound with molecular formula C10H7NO4 and molecular weight 205.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(5-nitro-1-benzofuran-2-yl)ethanone
Also Known As: 2-Acetyl-5-nitrobenzo[b]furan, 1-(5-nitrobenzofuran-2-yl)ethanone, 1-(5-Nitro-1-benzofuran-2-yl)ethanone, 2-Acetyl-5-nitrobenzofuran, Maybridge1_001103
| Molecular Formula | C10H7NO4 |
|---|---|
| Molecular Weight | 205.04 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 76.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 205.0375 |
| Heavy Atoms | 15 |
| Complexity | 286.0 |
Chemical Identifiers
| CAS Number | 2792-72-5 |
|---|---|
| SMILES | CC(=O)C1=CC2=C(O1)C=CC(=C2)[N+](=O)[O-] |
| InChIKey | RMXFQPLULZFJMH-UHFFFAOYSA-N |
Product Overview
1-(5-Nitro-1-benzofuran-2-YL)ethanone (CAS 2792-72-5), with molecular formula C10H7NO4 and molecular weight 205.04 g/mol. IUPAC: 1-(5-nitro-1-benzofuran-2-yl)ethanone.
Chemical Property Profile of 1-(5-Nitro-1-benzofuran-2-YL)ethanone
Property Insights of 1-(5-Nitro-1-benzofuran-2-YL)ethanone
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(5-Nitro-1-benzofuran-2-YL)ethanone. The TPSA of 76.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(5-Nitro-1-benzofuran-2-YL)ethanone. Following Lipinski's Rule of Five, 1-(5-Nitro-1-benzofuran-2-YL)ethanone 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 1-(5-Nitro-1-benzofuran-2-YL)ethanone?
The CAS number of 1-(5-Nitro-1-benzofuran-2-YL)ethanone is 2792-72-5.
What is the molecular formula of 1-(5-Nitro-1-benzofuran-2-YL)ethanone?
The molecular formula of 1-(5-Nitro-1-benzofuran-2-YL)ethanone is C10H7NO4.
What is the molecular weight of 1-(5-Nitro-1-benzofuran-2-YL)ethanone?
The molecular weight of 1-(5-Nitro-1-benzofuran-2-YL)ethanone is 205.04 g/mol.
Where can I buy 1-(5-Nitro-1-benzofuran-2-YL)ethanone?
You can request a quote for 1-(5-Nitro-1-benzofuran-2-YL)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(5-Nitro-1-benzofuran-2-YL)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(5-Nitro-1-benzofuran-2-YL)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.