![3-{[(2-Fluoro-5-nitrophenyl)imino]methyl}-1,2-benzenediol structure](/static/products/304/304478-53-3.png)
3-{[(2-Fluoro-5-nitrophenyl)imino]methyl}-1,2-benzenediol
TL;DR: 3-{[(2-Fluoro-5-nitrophenyl)imino]methyl}-1,2-benzenediol (CAS 304478-53-3) is a chemical compound with molecular formula C13H9FN2O4 and molecular weight 276.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(2-fluoro-5-nitrophenyl)iminomethyl]benzene-1,2-diol
Also Known As: 3-{[(2-fluoro-5-nitrophenyl)imino]methyl}-1,2-benzenediol, AN-329/40335813, Benzene-1,2-diol, 3-(2-fluoro-5-nitrophenyliminomethyl)-, 3-[(2-fluoro-5-nitrophenyl)iminomethyl]benzene-1,2-diol, 3-[({2-fluoro-5-nitrophenyl}imino)methyl]-1,2-benzenediol
| Molecular Formula | C13H9FN2O4 |
|---|---|
| Molecular Weight | 276.05 g/mol |
| LogP | 2.8957 |
| Topological Polar Surface Area | 95.96 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 276.05463 |
| Heavy Atoms | 20 |
| Complexity | 700.7657 |
Chemical Identifiers
| CAS Number | 304478-53-3 |
|---|---|
| SMILES | C1=CC(=C(C(=C1)O)O)C=NC2=C(C=CC(=C2)[N+](=O)[O-])F |
Product Overview
3-{[(2-Fluoro-5-nitrophenyl)imino]methyl}-1,2-benzenediol (CAS 304478-53-3), with molecular formula C13H9FN2O4 and molecular weight 276.05 g/mol. IUPAC: 3-[(2-fluoro-5-nitrophenyl)iminomethyl]benzene-1,2-diol.
Chemical Property Profile of 3-{[(2-Fluoro-5-nitrophenyl)imino]methyl}-1,2-benzenediol
Property Insights of 3-{[(2-Fluoro-5-nitrophenyl)imino]methyl}-1,2-benzenediol
The XLogP value of 2.8957 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-{[(2-Fluoro-5-nitrophenyl)imino]methyl}-1,2-benzenediol. The TPSA of 95.96 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-{[(2-Fluoro-5-nitrophenyl)imino]methyl}-1,2-benzenediol. Following Lipinski's Rule of Five, 3-{[(2-Fluoro-5-nitrophenyl)imino]methyl}-1,2-benzenediol 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 3-{[(2-Fluoro-5-nitrophenyl)imino]methyl}-1,2-benzenediol?
The CAS number of 3-{[(2-Fluoro-5-nitrophenyl)imino]methyl}-1,2-benzenediol is 304478-53-3.
What is the molecular formula of 3-{[(2-Fluoro-5-nitrophenyl)imino]methyl}-1,2-benzenediol?
The molecular formula of 3-{[(2-Fluoro-5-nitrophenyl)imino]methyl}-1,2-benzenediol is C13H9FN2O4.
What is the molecular weight of 3-{[(2-Fluoro-5-nitrophenyl)imino]methyl}-1,2-benzenediol?
The molecular weight of 3-{[(2-Fluoro-5-nitrophenyl)imino]methyl}-1,2-benzenediol is 276.05 g/mol.
Where can I buy 3-{[(2-Fluoro-5-nitrophenyl)imino]methyl}-1,2-benzenediol?
You can request a quote for 3-{[(2-Fluoro-5-nitrophenyl)imino]methyl}-1,2-benzenediol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-{[(2-Fluoro-5-nitrophenyl)imino]methyl}-1,2-benzenediol?
Yes, KEHONG BIO provides custom synthesis services for 3-{[(2-Fluoro-5-nitrophenyl)imino]methyl}-1,2-benzenediol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.