1,3,5-Triazido-2,4-dinitrobenzene
TL;DR: 1,3,5-Triazido-2,4-dinitrobenzene (CAS 98137-93-0) is a chemical compound with molecular formula C6HN11O4 and molecular weight 291.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3,5-triazido-2,4-dinitrobenzene
Also Known As: Ex101, 1,3,5-triazido-2,4-dinitro-benzene, 1,3,5-triazido-2,4-dinitrobenzene
| Molecular Formula | C6HN11O4 |
|---|---|
| Molecular Weight | 291.02 g/mol |
| LogP | 4.3284 |
| Topological Polar Surface Area | 232.56 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 291.0213 |
| Heavy Atoms | 21 |
| Complexity | 726.14343 |
Chemical Identifiers
| CAS Number | 98137-93-0 |
|---|---|
| SMILES | C1=C(C(=C(C(=C1N=[N+]=[N-])[N+](=O)[O-])N=[N+]=[N-])[N+](=O)[O-])N=[N+]=[N-] |
Product Overview
1,3,5-Triazido-2,4-dinitrobenzene (CAS 98137-93-0), with molecular formula C6HN11O4 and molecular weight 291.02 g/mol. IUPAC: 1,3,5-triazido-2,4-dinitrobenzene.
Chemical Property Profile of 1,3,5-Triazido-2,4-dinitrobenzene
Property Insights of 1,3,5-Triazido-2,4-dinitrobenzene
The XLogP value of 4.3284 indicates that 1,3,5-Triazido-2,4-dinitrobenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 232.56 Ų indicates high polarity, suggesting 1,3,5-Triazido-2,4-dinitrobenzene may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1,3,5-Triazido-2,4-dinitrobenzene has 0 hydrogen bond donor(s) and 7 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 1,3,5-Triazido-2,4-dinitrobenzene?
The CAS number of 1,3,5-Triazido-2,4-dinitrobenzene is 98137-93-0.
What is the molecular formula of 1,3,5-Triazido-2,4-dinitrobenzene?
The molecular formula of 1,3,5-Triazido-2,4-dinitrobenzene is C6HN11O4.
What is the molecular weight of 1,3,5-Triazido-2,4-dinitrobenzene?
The molecular weight of 1,3,5-Triazido-2,4-dinitrobenzene is 291.02 g/mol.
Where can I buy 1,3,5-Triazido-2,4-dinitrobenzene?
You can request a quote for 1,3,5-Triazido-2,4-dinitrobenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3,5-Triazido-2,4-dinitrobenzene?
Yes, KEHONG BIO provides custom synthesis services for 1,3,5-Triazido-2,4-dinitrobenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.