1,3,5-Tribromo-2,4,6-trinitrobenzene
TL;DR: 1,3,5-Tribromo-2,4,6-trinitrobenzene (CAS 83430-12-0) is a chemical compound with molecular formula C6Br3N3O6 and molecular weight 446.73 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3,5-tribromo-2,4,6-trinitrobenzene
Also Known As: 1,3,5-tribromo-2,4,6-trinitrobenzene, 1,3,5-tribromo-2,4,6-trinitro-benzene, Benzene, 1,3,5-tribromo-2,4,6-trinitro-, J3.199.612K, RefChem:217419
| Molecular Formula | C6Br3N3O6 |
|---|---|
| Molecular Weight | 446.73 g/mol |
| LogP | 3.6987 |
| Topological Polar Surface Area | 129.42 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 446.73373 |
| Heavy Atoms | 18 |
| Complexity | 486.39395 |
Chemical Identifiers
| CAS Number | 83430-12-0 |
|---|---|
| SMILES | C1(=C(C(=C(C(=C1Br)[N+](=O)[O-])Br)[N+](=O)[O-])Br)[N+](=O)[O-] |
Product Overview
1,3,5-Tribromo-2,4,6-trinitrobenzene (CAS 83430-12-0), with molecular formula C6Br3N3O6 and molecular weight 446.73 g/mol. IUPAC: 1,3,5-tribromo-2,4,6-trinitrobenzene.
Chemical Property Profile of 1,3,5-Tribromo-2,4,6-trinitrobenzene
Property Insights of 1,3,5-Tribromo-2,4,6-trinitrobenzene
The XLogP value of 3.6987 indicates that 1,3,5-Tribromo-2,4,6-trinitrobenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 129.42 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3,5-Tribromo-2,4,6-trinitrobenzene. Following Lipinski's Rule of Five, 1,3,5-Tribromo-2,4,6-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 1,3,5-Tribromo-2,4,6-trinitrobenzene?
The CAS number of 1,3,5-Tribromo-2,4,6-trinitrobenzene is 83430-12-0.
What is the molecular formula of 1,3,5-Tribromo-2,4,6-trinitrobenzene?
The molecular formula of 1,3,5-Tribromo-2,4,6-trinitrobenzene is C6Br3N3O6.
What is the molecular weight of 1,3,5-Tribromo-2,4,6-trinitrobenzene?
The molecular weight of 1,3,5-Tribromo-2,4,6-trinitrobenzene is 446.73 g/mol.
Where can I buy 1,3,5-Tribromo-2,4,6-trinitrobenzene?
You can request a quote for 1,3,5-Tribromo-2,4,6-trinitrobenzene 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-Tribromo-2,4,6-trinitrobenzene?
Yes, KEHONG BIO provides custom synthesis services for 1,3,5-Tribromo-2,4,6-trinitrobenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.