2,4-Dichloro-1,3,5-trinitrobenzene
TL;DR: 2,4-Dichloro-1,3,5-trinitrobenzene (CAS 90171-11-2) is a chemical compound with molecular formula C6HCl2N3O6 and molecular weight 280.92 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4-dichloro-1,3,5-trinitrobenzene
Also Known As: 2,4-dichloro-1,3,5-trinitrobenzene, Styphnyl chloride, 1,3-DICHLORO-2,4,6-TRINITROBENZENE, Ex061, 2,4-dichloro-1,3,5-trinitro-benzene
| Molecular Formula | C6HCl2N3O6 |
|---|---|
| Molecular Weight | 280.92 g/mol |
| LogP | 2.718 |
| Topological Polar Surface Area | 129.42 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 280.92422 |
| Heavy Atoms | 17 |
| Complexity | 506.79254 |
Chemical Identifiers
| CAS Number | 90171-11-2 |
|---|---|
| SMILES | C1=C(C(=C(C(=C1[N+](=O)[O-])Cl)[N+](=O)[O-])Cl)[N+](=O)[O-] |
Product Overview
2,4-Dichloro-1,3,5-trinitrobenzene (CAS 90171-11-2), with molecular formula C6HCl2N3O6 and molecular weight 280.92 g/mol. IUPAC: 2,4-dichloro-1,3,5-trinitrobenzene.
Chemical Property Profile of 2,4-Dichloro-1,3,5-trinitrobenzene
Property Insights of 2,4-Dichloro-1,3,5-trinitrobenzene
The XLogP value of 2.718 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4-Dichloro-1,3,5-trinitrobenzene. The TPSA of 129.42 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,4-Dichloro-1,3,5-trinitrobenzene. Following Lipinski's Rule of Five, 2,4-Dichloro-1,3,5-trinitrobenzene has 0 hydrogen bond donor(s) and 6 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-Dichloro-1,3,5-trinitrobenzene?
The CAS number of 2,4-Dichloro-1,3,5-trinitrobenzene is 90171-11-2.
What is the molecular formula of 2,4-Dichloro-1,3,5-trinitrobenzene?
The molecular formula of 2,4-Dichloro-1,3,5-trinitrobenzene is C6HCl2N3O6.
What is the molecular weight of 2,4-Dichloro-1,3,5-trinitrobenzene?
The molecular weight of 2,4-Dichloro-1,3,5-trinitrobenzene is 280.92 g/mol.
Where can I buy 2,4-Dichloro-1,3,5-trinitrobenzene?
You can request a quote for 2,4-Dichloro-1,3,5-trinitrobenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-Dichloro-1,3,5-trinitrobenzene?
Yes, KEHONG BIO provides custom synthesis services for 2,4-Dichloro-1,3,5-trinitrobenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.