2,4-Dinitro-1-benzofuran
TL;DR: 2,4-Dinitro-1-benzofuran (CAS 69227-68-5) is a chemical compound with molecular formula C8H4N2O5 and molecular weight 208.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4-dinitro-1-benzofuran
Also Known As: 2,4-dinitro-1-benzofuran, 2,4-dinitrobenzofuran, 2,4-dinitro-benzofuran, NCI60_002870
| Molecular Formula | C8H4N2O5 |
|---|---|
| Molecular Weight | 208.01 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 105.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 208.01202 |
| Heavy Atoms | 15 |
| Complexity | 284.0 |
Chemical Identifiers
| CAS Number | 69227-68-5 |
|---|---|
| SMILES | C1=CC(=C2C=C(OC2=C1)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | MOECQHRJENTFOF-UHFFFAOYSA-N |
Product Overview
2,4-Dinitro-1-benzofuran (CAS 69227-68-5), with molecular formula C8H4N2O5 and molecular weight 208.01 g/mol. IUPAC: 2,4-dinitro-1-benzofuran.
Chemical Property Profile of 2,4-Dinitro-1-benzofuran
Property Insights of 2,4-Dinitro-1-benzofuran
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4-Dinitro-1-benzofuran. The TPSA of 105.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,4-Dinitro-1-benzofuran. Following Lipinski's Rule of Five, 2,4-Dinitro-1-benzofuran has 0 hydrogen bond donor(s) and 5 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 2,4-Dinitro-1-benzofuran?
The CAS number of 2,4-Dinitro-1-benzofuran is 69227-68-5.
What is the molecular formula of 2,4-Dinitro-1-benzofuran?
The molecular formula of 2,4-Dinitro-1-benzofuran is C8H4N2O5.
What is the molecular weight of 2,4-Dinitro-1-benzofuran?
The molecular weight of 2,4-Dinitro-1-benzofuran is 208.01 g/mol.
Where can I buy 2,4-Dinitro-1-benzofuran?
You can request a quote for 2,4-Dinitro-1-benzofuran directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-Dinitro-1-benzofuran?
Yes, KEHONG BIO provides custom synthesis services for 2,4-Dinitro-1-benzofuran and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.