1,5-Dinitrophenanthrene
TL;DR: 1,5-Dinitrophenanthrene (CAS 159092-66-7) is a chemical compound with molecular formula C14H8N2O4 and molecular weight 268.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,5-dinitrophenanthrene
Also Known As: 1,5-Dinitrophenanthrene, RefChem:221349
| Molecular Formula | C14H8N2O4 |
|---|---|
| Molecular Weight | 268.05 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 91.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 268.0484 |
| Heavy Atoms | 20 |
| Complexity | 403.0 |
Chemical Identifiers
| CAS Number | 159092-66-7 |
|---|---|
| SMILES | C1=CC2=C(C3=C(C=C2)C(=CC=C3)[N+](=O)[O-])C(=C1)[N+](=O)[O-] |
| InChIKey | GXMKYMAHWSOTKV-UHFFFAOYSA-N |
Product Overview
1,5-Dinitrophenanthrene (CAS 159092-66-7), with molecular formula C14H8N2O4 and molecular weight 268.05 g/mol. IUPAC: 1,5-dinitrophenanthrene.
Chemical Property Profile of 1,5-Dinitrophenanthrene
Property Insights of 1,5-Dinitrophenanthrene
The XLogP value of 3.8 indicates that 1,5-Dinitrophenanthrene 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 1,5-Dinitrophenanthrene. Following Lipinski's Rule of Five, 1,5-Dinitrophenanthrene 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 1,5-Dinitrophenanthrene?
The CAS number of 1,5-Dinitrophenanthrene is 159092-66-7.
What is the molecular formula of 1,5-Dinitrophenanthrene?
The molecular formula of 1,5-Dinitrophenanthrene is C14H8N2O4.
What is the molecular weight of 1,5-Dinitrophenanthrene?
The molecular weight of 1,5-Dinitrophenanthrene is 268.05 g/mol.
Where can I buy 1,5-Dinitrophenanthrene?
You can request a quote for 1,5-Dinitrophenanthrene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,5-Dinitrophenanthrene?
Yes, KEHONG BIO provides custom synthesis services for 1,5-Dinitrophenanthrene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.