2-Nitrobenzene-1,4-diamine hydrochloride
TL;DR: 2-Nitrobenzene-1,4-diamine hydrochloride (CAS 71776-05-1) is a chemical compound with molecular formula C6H8ClN3O2 and molecular weight 189.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-nitrobenzene-1,4-diamine;hydrochloride
Also Known As: 2-Nitrobenzene-1,4-diamine hydrochloride, EINECS 276-000-1, 1,4-Diamino-2-nitrobenzene HCl, 2-nitrobenzene-1,4-diamine,hydrochloride, 2-nitro-1,4-phenylenediamine hydrochloride
| Molecular Formula | C6H8ClN3O2 |
|---|---|
| Molecular Weight | 189.03 g/mol |
| LogP | 1.181 |
| Topological Polar Surface Area | 95.18 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 189.0305 |
| Heavy Atoms | 12 |
| Complexity | 302.84473 |
Chemical Identifiers
| CAS Number | 71776-05-1 |
|---|---|
| SMILES | C1=CC(=C(C=C1N)[N+](=O)[O-])N.Cl |
Product Overview
2-Nitrobenzene-1,4-diamine hydrochloride (CAS 71776-05-1), with molecular formula C6H8ClN3O2 and molecular weight 189.03 g/mol. IUPAC: 2-nitrobenzene-1,4-diamine;hydrochloride.
Chemical Property Profile of 2-Nitrobenzene-1,4-diamine hydrochloride
Property Insights of 2-Nitrobenzene-1,4-diamine hydrochloride
The XLogP value of 1.181 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Nitrobenzene-1,4-diamine hydrochloride. The TPSA of 95.18 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Nitrobenzene-1,4-diamine hydrochloride. Following Lipinski's Rule of Five, 2-Nitrobenzene-1,4-diamine hydrochloride 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 2-Nitrobenzene-1,4-diamine hydrochloride?
The CAS number of 2-Nitrobenzene-1,4-diamine hydrochloride is 71776-05-1.
What is the molecular formula of 2-Nitrobenzene-1,4-diamine hydrochloride?
The molecular formula of 2-Nitrobenzene-1,4-diamine hydrochloride is C6H8ClN3O2.
What is the molecular weight of 2-Nitrobenzene-1,4-diamine hydrochloride?
The molecular weight of 2-Nitrobenzene-1,4-diamine hydrochloride is 189.03 g/mol.
Where can I buy 2-Nitrobenzene-1,4-diamine hydrochloride?
You can request a quote for 2-Nitrobenzene-1,4-diamine hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Nitrobenzene-1,4-diamine hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 2-Nitrobenzene-1,4-diamine hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.