2,7-Dinitropyrene
TL;DR: 2,7-Dinitropyrene (CAS 117929-15-4) is a chemical compound with molecular formula C16H8N2O4 and molecular weight 292.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,7-dinitropyrene
Also Known As: 2,7-Dinitropyrene, Pyrene, 2,7-dinitro-, Pyrene,2,7-dinitro
| Molecular Formula | C16H8N2O4 |
|---|---|
| Molecular Weight | 292.05 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 91.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 292.0484 |
| Heavy Atoms | 22 |
| Complexity | 414.0 |
Chemical Identifiers
| CAS Number | 117929-15-4 |
|---|---|
| SMILES | C1=CC2=CC(=CC3=C2C4=C(C=C3)C=C(C=C41)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | UTESMPAHZRAKMZ-UHFFFAOYSA-N |
Product Overview
2,7-Dinitropyrene (CAS 117929-15-4), with molecular formula C16H8N2O4 and molecular weight 292.05 g/mol. IUPAC: 2,7-dinitropyrene.
Chemical Property Profile of 2,7-Dinitropyrene
Property Insights of 2,7-Dinitropyrene
The XLogP value of 4.7 indicates that 2,7-Dinitropyrene 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-Dinitropyrene. Following Lipinski's Rule of Five, 2,7-Dinitropyrene 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-Dinitropyrene?
The CAS number of 2,7-Dinitropyrene is 117929-15-4.
What is the molecular formula of 2,7-Dinitropyrene?
The molecular formula of 2,7-Dinitropyrene is C16H8N2O4.
What is the molecular weight of 2,7-Dinitropyrene?
The molecular weight of 2,7-Dinitropyrene is 292.05 g/mol.
Where can I buy 2,7-Dinitropyrene?
You can request a quote for 2,7-Dinitropyrene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,7-Dinitropyrene?
Yes, KEHONG BIO provides custom synthesis services for 2,7-Dinitropyrene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.