3,7-Dinitrofluoranthene
TL;DR: 3,7-Dinitrofluoranthene (CAS 105735-71-5) is a chemical compound with molecular formula C16H8N2O4 and molecular weight 292.0484 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3,7-dinitrofluoranthene
Also Known As: 3,7-Dinitrofluoranthene, Fluoranthene, 3,7-dinitro, Fluoranthene,3,7-dinitro, FLUORANTHENE, 3,7-DINITRO-, DINITROFLUORANTHENE, 3,7-
Technical Specifications
| Molecular Formula | C16H8N2O4 |
| Molecular Weight | 292.0484 g/mol |
| XLogP | 4.2 |
| Topological Polar Surface Area (TPSA) | 91.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 292.0484 Da |
| Heavy Atoms | 22 |
| Complexity | 486.0 |
| Melting Point | 203-204 °C |
| Solubility | Practically insol in water. |
| SMILES | C1=CC2=C(C=CC3=C2C(=C1)C4=C3C=CC=C4[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | WAAHHGKGQYVTNS-UHFFFAOYSA-N |
Chemical Property Profile of 3,7-Dinitrofluoranthene
Property Insights of 3,7-Dinitrofluoranthene
The XLogP value of 4.2 indicates that 3,7-Dinitrofluoranthene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,7-Dinitrofluoranthene. Following Lipinski's Rule of Five, 3,7-Dinitrofluoranthene 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
What is the CAS number of 3,7-Dinitrofluoranthene?
The CAS number of 3,7-Dinitrofluoranthene is 105735-71-5.
What is the molecular formula of 3,7-Dinitrofluoranthene?
The molecular formula of 3,7-Dinitrofluoranthene is C16H8N2O4.
What is the molecular weight of 3,7-Dinitrofluoranthene?
The molecular weight of 3,7-Dinitrofluoranthene is 292.0484 g/mol.
Where can I buy 3,7-Dinitrofluoranthene?
You can request a quote for 3,7-Dinitrofluoranthene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3,7-Dinitrofluoranthene?
Yes, CoreyChem provides custom synthesis services for 3,7-Dinitrofluoranthene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.