N-(2,4-Dinitrophenyl)-1-naphthalenamine
TL;DR: N-(2,4-Dinitrophenyl)-1-naphthalenamine (CAS 6746-42-5) is a chemical compound with molecular formula C16H11N3O4 and molecular weight 309.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,4-dinitrophenyl)naphthalen-1-amine
Also Known As: N-(2,4-dinitrophenyl)naphthalen-1-amine, N-(2,4-Dinitrophenyl)-1-naphthalenamine, (2,4-dinitrophenyl)naphthylamine, (2,4-dinitrophenyl)1-naphthylamine, N-(2,4-Dinitrophenyl)-1-naphthylamine
| Molecular Formula | C16H11N3O4 |
|---|---|
| Molecular Weight | 309.07 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 104.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 309.07495 |
| Heavy Atoms | 23 |
| Complexity | 448.0 |
Chemical Identifiers
| CAS Number | 6746-42-5 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC=C2NC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | ZCDMKBLVPCWKGH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-(2,4-Dinitrophenyl)-1-naphthalenamine (CAS 6746-42-5), with molecular formula C16H11N3O4 and molecular weight 309.07 g/mol. IUPAC: N-(2,4-dinitrophenyl)naphthalen-1-amine.
Chemical Property Profile of N-(2,4-Dinitrophenyl)-1-naphthalenamine
Property Insights of N-(2,4-Dinitrophenyl)-1-naphthalenamine
The XLogP value of 4.9 indicates that N-(2,4-Dinitrophenyl)-1-naphthalenamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2,4-Dinitrophenyl)-1-naphthalenamine. Following Lipinski's Rule of Five, N-(2,4-Dinitrophenyl)-1-naphthalenamine has 1 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 N-(2,4-Dinitrophenyl)-1-naphthalenamine?
The CAS number of N-(2,4-Dinitrophenyl)-1-naphthalenamine is 6746-42-5.
What is the molecular formula of N-(2,4-Dinitrophenyl)-1-naphthalenamine?
The molecular formula of N-(2,4-Dinitrophenyl)-1-naphthalenamine is C16H11N3O4.
What is the molecular weight of N-(2,4-Dinitrophenyl)-1-naphthalenamine?
The molecular weight of N-(2,4-Dinitrophenyl)-1-naphthalenamine is 309.07 g/mol.
Where can I buy N-(2,4-Dinitrophenyl)-1-naphthalenamine?
You can request a quote for N-(2,4-Dinitrophenyl)-1-naphthalenamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2,4-Dinitrophenyl)-1-naphthalenamine?
Yes, KEHONG BIO provides custom synthesis services for N-(2,4-Dinitrophenyl)-1-naphthalenamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.