1-Bromo-4,5-dinitronaphthalene
TL;DR: 1-Bromo-4,5-dinitronaphthalene (CAS 4185-60-8) is a chemical compound with molecular formula C10H5BrN2O4 and molecular weight 295.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-bromo-4,5-dinitronaphthalene
Also Known As: 1-bromo-4,5-dinitronaphthalene, AE-562/12222072, A2299/0096874
| Molecular Formula | C10H5BrN2O4 |
|---|---|
| Molecular Weight | 295.94 g/mol |
| LogP | 3.4187 |
| Topological Polar Surface Area | 86.28 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 295.94327 |
| Heavy Atoms | 17 |
| Complexity | 621.23364 |
Chemical Identifiers
| CAS Number | 4185-60-8 |
|---|---|
| SMILES | C1=CC2=C(C=CC(=C2C(=C1)[N+](=O)[O-])[N+](=O)[O-])Br |
Product Overview
1-Bromo-4,5-dinitronaphthalene (CAS 4185-60-8), with molecular formula C10H5BrN2O4 and molecular weight 295.94 g/mol. IUPAC: 1-bromo-4,5-dinitronaphthalene.
Chemical Property Profile of 1-Bromo-4,5-dinitronaphthalene
Property Insights of 1-Bromo-4,5-dinitronaphthalene
The XLogP value of 3.4187 indicates that 1-Bromo-4,5-dinitronaphthalene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.28 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Bromo-4,5-dinitronaphthalene. Following Lipinski's Rule of Five, 1-Bromo-4,5-dinitronaphthalene has 0 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 1-Bromo-4,5-dinitronaphthalene?
The CAS number of 1-Bromo-4,5-dinitronaphthalene is 4185-60-8.
What is the molecular formula of 1-Bromo-4,5-dinitronaphthalene?
The molecular formula of 1-Bromo-4,5-dinitronaphthalene is C10H5BrN2O4.
What is the molecular weight of 1-Bromo-4,5-dinitronaphthalene?
The molecular weight of 1-Bromo-4,5-dinitronaphthalene is 295.94 g/mol.
Where can I buy 1-Bromo-4,5-dinitronaphthalene?
You can request a quote for 1-Bromo-4,5-dinitronaphthalene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Bromo-4,5-dinitronaphthalene?
Yes, KEHONG BIO provides custom synthesis services for 1-Bromo-4,5-dinitronaphthalene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.