2-Chloro-2'-nitrodiphenylamine
TL;DR: 2-Chloro-2'-nitrodiphenylamine (CAS 74002-26-9) is a chemical compound with molecular formula C12H9ClN2O2 and molecular weight 248.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-chlorophenyl)-2-nitroaniline
Also Known As: Clofazimine Impurity 10, 2-Chloro-2'-nitrodiphenylamine, N-(2-chlorophenyl)-2-nitroaniline, 2-Chlorophenyl 2-nitrophenylamine, 2-Nitrophenyl 2-chlorophenylamine
| Molecular Formula | C12H9ClN2O2 |
|---|---|
| Molecular Weight | 248.04 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 57.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 248.03525 |
| Heavy Atoms | 17 |
| Complexity | 270.0 |
Chemical Identifiers
| CAS Number | 74002-26-9 |
|---|---|
| SMILES | C1=CC=C(C(=C1)NC2=CC=CC=C2Cl)[N+](=O)[O-] |
| InChIKey | CJQALZGBECBANO-UHFFFAOYSA-N |
Product Overview
2-Chloro-2'-nitrodiphenylamine (CAS 74002-26-9), with molecular formula C12H9ClN2O2 and molecular weight 248.04 g/mol. IUPAC: N-(2-chlorophenyl)-2-nitroaniline.
Chemical Property Profile of 2-Chloro-2'-nitrodiphenylamine
Property Insights of 2-Chloro-2'-nitrodiphenylamine
The XLogP value of 4.3 indicates that 2-Chloro-2'-nitrodiphenylamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.9 Ų, 2-Chloro-2'-nitrodiphenylamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chloro-2'-nitrodiphenylamine has 1 hydrogen bond donor(s) and 3 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-Chloro-2'-nitrodiphenylamine?
The CAS number of 2-Chloro-2'-nitrodiphenylamine is 74002-26-9.
What is the molecular formula of 2-Chloro-2'-nitrodiphenylamine?
The molecular formula of 2-Chloro-2'-nitrodiphenylamine is C12H9ClN2O2.
What is the molecular weight of 2-Chloro-2'-nitrodiphenylamine?
The molecular weight of 2-Chloro-2'-nitrodiphenylamine is 248.04 g/mol.
Where can I buy 2-Chloro-2'-nitrodiphenylamine?
You can request a quote for 2-Chloro-2'-nitrodiphenylamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chloro-2'-nitrodiphenylamine?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloro-2'-nitrodiphenylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.