4-chloro-3-N-methyl-6-nitrobenzene-1,3-diamine
TL;DR: 4-chloro-3-N-methyl-6-nitrobenzene-1,3-diamine (CAS 90196-36-4) is a chemical compound with molecular formula C7H8ClN3O2 and molecular weight 201.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-3-N-methyl-6-nitrobenzene-1,3-diamine
Also Known As: 4-Chlor-6-nitro-3-methylamino-anilin, 4-chloro-3-N-methyl-6-nitrobenzene-1,3-diamine, 4-chloro-N'-methyl-6-nitro-benzene-1,3-diamine
| Molecular Formula | C7H8ClN3O2 |
|---|---|
| Molecular Weight | 201.03 g/mol |
| LogP | 1.8721 |
| Topological Polar Surface Area | 81.19 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 201.0305 |
| Heavy Atoms | 13 |
| Complexity | 353.83606 |
Chemical Identifiers
| CAS Number | 90196-36-4 |
|---|---|
| SMILES | CNC1=C(C=C(C(=C1)N)[N+](=O)[O-])Cl |
Product Overview
4-chloro-3-N-methyl-6-nitrobenzene-1,3-diamine (CAS 90196-36-4), with molecular formula C7H8ClN3O2 and molecular weight 201.03 g/mol. IUPAC: 4-chloro-3-N-methyl-6-nitrobenzene-1,3-diamine.
Chemical Property Profile of 4-chloro-3-N-methyl-6-nitrobenzene-1,3-diamine
Property Insights of 4-chloro-3-N-methyl-6-nitrobenzene-1,3-diamine
The XLogP value of 1.8721 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-chloro-3-N-methyl-6-nitrobenzene-1,3-diamine. The TPSA of 81.19 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-chloro-3-N-methyl-6-nitrobenzene-1,3-diamine. Following Lipinski's Rule of Five, 4-chloro-3-N-methyl-6-nitrobenzene-1,3-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-chloro-3-N-methyl-6-nitrobenzene-1,3-diamine?
The CAS number of 4-chloro-3-N-methyl-6-nitrobenzene-1,3-diamine is 90196-36-4.
What is the molecular formula of 4-chloro-3-N-methyl-6-nitrobenzene-1,3-diamine?
The molecular formula of 4-chloro-3-N-methyl-6-nitrobenzene-1,3-diamine is C7H8ClN3O2.
What is the molecular weight of 4-chloro-3-N-methyl-6-nitrobenzene-1,3-diamine?
The molecular weight of 4-chloro-3-N-methyl-6-nitrobenzene-1,3-diamine is 201.03 g/mol.
Where can I buy 4-chloro-3-N-methyl-6-nitrobenzene-1,3-diamine?
You can request a quote for 4-chloro-3-N-methyl-6-nitrobenzene-1,3-diamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-chloro-3-N-methyl-6-nitrobenzene-1,3-diamine?
Yes, KEHONG BIO provides custom synthesis services for 4-chloro-3-N-methyl-6-nitrobenzene-1,3-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.