1-(2,6-Dihydroxy-3-nitrophenyl)ethanone
TL;DR: 1-(2,6-Dihydroxy-3-nitrophenyl)ethanone (CAS 25205-34-9) is a chemical compound with molecular formula C8H7NO5 and molecular weight 197.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,6-dihydroxy-3-nitrophenyl)ethanone
Also Known As: ghl.PD_Mitscher_leg0.1175, 2,6-dihydroxy-3-nitroacetophenone, 1-(2,6-dihydroxy-3-nitrophenyl)ethanone, Ethanone, 1-(2,6-dihydroxy-3-nitrophenyl)-
| Molecular Formula | C8H7NO5 |
|---|---|
| Molecular Weight | 197.03 g/mol |
| LogP | 1.2086 |
| Topological Polar Surface Area | 100.67 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 197.03242 |
| Heavy Atoms | 14 |
| Complexity | 412.4378 |
Chemical Identifiers
| CAS Number | 25205-34-9 |
|---|---|
| SMILES | CC(=O)C1=C(C=CC(=C1O)[N+](=O)[O-])O |
Product Overview
1-(2,6-Dihydroxy-3-nitrophenyl)ethanone (CAS 25205-34-9), with molecular formula C8H7NO5 and molecular weight 197.03 g/mol. IUPAC: 1-(2,6-dihydroxy-3-nitrophenyl)ethanone.
Chemical Property Profile of 1-(2,6-Dihydroxy-3-nitrophenyl)ethanone
Property Insights of 1-(2,6-Dihydroxy-3-nitrophenyl)ethanone
The XLogP value of 1.2086 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2,6-Dihydroxy-3-nitrophenyl)ethanone. The TPSA of 100.67 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2,6-Dihydroxy-3-nitrophenyl)ethanone. Following Lipinski's Rule of Five, 1-(2,6-Dihydroxy-3-nitrophenyl)ethanone has 2 hydrogen bond donor(s) and 5 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-(2,6-Dihydroxy-3-nitrophenyl)ethanone?
The CAS number of 1-(2,6-Dihydroxy-3-nitrophenyl)ethanone is 25205-34-9.
What is the molecular formula of 1-(2,6-Dihydroxy-3-nitrophenyl)ethanone?
The molecular formula of 1-(2,6-Dihydroxy-3-nitrophenyl)ethanone is C8H7NO5.
What is the molecular weight of 1-(2,6-Dihydroxy-3-nitrophenyl)ethanone?
The molecular weight of 1-(2,6-Dihydroxy-3-nitrophenyl)ethanone is 197.03 g/mol.
Where can I buy 1-(2,6-Dihydroxy-3-nitrophenyl)ethanone?
You can request a quote for 1-(2,6-Dihydroxy-3-nitrophenyl)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2,6-Dihydroxy-3-nitrophenyl)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(2,6-Dihydroxy-3-nitrophenyl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.