2-Hydroxy-1-(3-nitrophenyl)-1-ethanone
TL;DR: 2-Hydroxy-1-(3-nitrophenyl)-1-ethanone (CAS 89894-07-5) is a chemical compound with molecular formula C8H7NO4 and molecular weight 181.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hydroxy-1-(3-nitrophenyl)ethanone
Also Known As: 2-hydroxy-1-(3-nitrophenyl)ethanone, 2-hydroxy-1-(3-nitrophenyl)-1-ethanone, PROPYNAL, m-nitrophenacyl alcohol, 2-Hydroxy-3'-nitroacetophenone
| Molecular Formula | C8H7NO4 |
|---|---|
| Molecular Weight | 181.04 g/mol |
| LogP | 0.7698 |
| Topological Polar Surface Area | 80.44 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 181.0375 |
| Heavy Atoms | 13 |
| Complexity | 347.7522 |
Chemical Identifiers
| CAS Number | 89894-07-5 |
|---|---|
| SMILES | C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)CO |
Product Overview
2-Hydroxy-1-(3-nitrophenyl)-1-ethanone (CAS 89894-07-5), with molecular formula C8H7NO4 and molecular weight 181.04 g/mol. IUPAC: 2-hydroxy-1-(3-nitrophenyl)ethanone.
Chemical Property Profile of 2-Hydroxy-1-(3-nitrophenyl)-1-ethanone
Property Insights of 2-Hydroxy-1-(3-nitrophenyl)-1-ethanone
The XLogP value of 0.7698 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Hydroxy-1-(3-nitrophenyl)-1-ethanone. The TPSA of 80.44 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Hydroxy-1-(3-nitrophenyl)-1-ethanone. Following Lipinski's Rule of Five, 2-Hydroxy-1-(3-nitrophenyl)-1-ethanone has 1 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 2-Hydroxy-1-(3-nitrophenyl)-1-ethanone?
The CAS number of 2-Hydroxy-1-(3-nitrophenyl)-1-ethanone is 89894-07-5.
What is the molecular formula of 2-Hydroxy-1-(3-nitrophenyl)-1-ethanone?
The molecular formula of 2-Hydroxy-1-(3-nitrophenyl)-1-ethanone is C8H7NO4.
What is the molecular weight of 2-Hydroxy-1-(3-nitrophenyl)-1-ethanone?
The molecular weight of 2-Hydroxy-1-(3-nitrophenyl)-1-ethanone is 181.04 g/mol.
Where can I buy 2-Hydroxy-1-(3-nitrophenyl)-1-ethanone?
You can request a quote for 2-Hydroxy-1-(3-nitrophenyl)-1-ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Hydroxy-1-(3-nitrophenyl)-1-ethanone?
Yes, KEHONG BIO provides custom synthesis services for 2-Hydroxy-1-(3-nitrophenyl)-1-ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.