4-Fluoro-5-nitrobenzene-1,2-diamine
TL;DR: 4-Fluoro-5-nitrobenzene-1,2-diamine (CAS 113269-06-0) is a chemical compound with molecular formula C6H6FN3O2 and molecular weight 171.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-fluoro-5-nitrobenzene-1,2-diamine
Also Known As: 4-fluoro-5-nitrobenzene-1,2-diamine, (R)-3-Isobutylmorpholine, 1,2-Benzenediamine,4-fluoro-5-nitro-, 4,5-Diamine-2-fluoronitrobenzene, 1,2-Benzenediamine, 4-fluoro-5-nitro-
| Molecular Formula | C6H6FN3O2 |
|---|---|
| Molecular Weight | 171.04 g/mol |
| LogP | 0.8983 |
| Topological Polar Surface Area | 95.18 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 171.0444 |
| Heavy Atoms | 12 |
| Complexity | 339.81024 |
Chemical Identifiers
| CAS Number | 113269-06-0 |
|---|---|
| SMILES | C1=C(C(=CC(=C1[N+](=O)[O-])F)N)N |
Product Overview
4-Fluoro-5-nitrobenzene-1,2-diamine (CAS 113269-06-0), with molecular formula C6H6FN3O2 and molecular weight 171.04 g/mol. IUPAC: 4-fluoro-5-nitrobenzene-1,2-diamine.
Chemical Property Profile of 4-Fluoro-5-nitrobenzene-1,2-diamine
Property Insights of 4-Fluoro-5-nitrobenzene-1,2-diamine
The XLogP value of 0.8983 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Fluoro-5-nitrobenzene-1,2-diamine. The TPSA of 95.18 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Fluoro-5-nitrobenzene-1,2-diamine. Following Lipinski's Rule of Five, 4-Fluoro-5-nitrobenzene-1,2-diamine has 2 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 4-Fluoro-5-nitrobenzene-1,2-diamine?
The CAS number of 4-Fluoro-5-nitrobenzene-1,2-diamine is 113269-06-0.
What is the molecular formula of 4-Fluoro-5-nitrobenzene-1,2-diamine?
The molecular formula of 4-Fluoro-5-nitrobenzene-1,2-diamine is C6H6FN3O2.
What is the molecular weight of 4-Fluoro-5-nitrobenzene-1,2-diamine?
The molecular weight of 4-Fluoro-5-nitrobenzene-1,2-diamine is 171.04 g/mol.
Where can I buy 4-Fluoro-5-nitrobenzene-1,2-diamine?
You can request a quote for 4-Fluoro-5-nitrobenzene-1,2-diamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Fluoro-5-nitrobenzene-1,2-diamine?
Yes, KEHONG BIO provides custom synthesis services for 4-Fluoro-5-nitrobenzene-1,2-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.