2,7-Dinitrofluorene
TL;DR: 2,7-Dinitrofluorene (CAS 5405-53-8) is a chemical compound with molecular formula C13H8N2O4 and molecular weight 256.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,7-dinitro-9H-fluorene
Also Known As: 2,7-DINITROFLUORENE, 2,7-Dinitro-9H-fluorene, 9H-Fluorene, 2,7-dinitro-, Fluorene, 2,7-dinitro-, 2,7-dinitrofluoren
| Molecular Formula | C13H8N2O4 |
|---|---|
| Molecular Weight | 256.05 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 91.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 256.0484 |
| Heavy Atoms | 19 |
| Complexity | 353.0 |
| Vapor Pressure | 0.00000019 [mmHg] |
Chemical Identifiers
| CAS Number | 5405-53-8 |
|---|---|
| SMILES | C1C2=C(C=CC(=C2)[N+](=O)[O-])C3=C1C=C(C=C3)[N+](=O)[O-] |
| InChIKey | IHZCVUBSTYOFSJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,7-Dinitrofluorene (CAS 5405-53-8), with molecular formula C13H8N2O4 and molecular weight 256.05 g/mol. IUPAC: 2,7-dinitro-9H-fluorene.
Chemical Property Profile of 2,7-Dinitrofluorene
Property Insights of 2,7-Dinitrofluorene
The XLogP value of 3.4 indicates that 2,7-Dinitrofluorene 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 2,7-Dinitrofluorene. Following Lipinski's Rule of Five, 2,7-Dinitrofluorene 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 2,7-Dinitrofluorene?
The CAS number of 2,7-Dinitrofluorene is 5405-53-8.
What is the molecular formula of 2,7-Dinitrofluorene?
The molecular formula of 2,7-Dinitrofluorene is C13H8N2O4.
What is the molecular weight of 2,7-Dinitrofluorene?
The molecular weight of 2,7-Dinitrofluorene is 256.05 g/mol.
Where can I buy 2,7-Dinitrofluorene?
You can request a quote for 2,7-Dinitrofluorene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,7-Dinitrofluorene?
Yes, KEHONG BIO provides custom synthesis services for 2,7-Dinitrofluorene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.