苦基氟
TL;DR: 苦基氟 (CAS 364-44-3) is a chemical compound with molecular formula C6H2FN3O6 and molecular weight 230.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
苦基氟
2-fluoro-1,3,5-trinitrobenzene
Also Known As: picryl fluoride, Trinitrofluorobenzene, 1-Fluoro-2,4,6-trinitrobenzene, 2-Fluoro-1,3,5-trinitrobenzene, 2,4,6-Trinitrofluorobenzene
| Molecular Formula | C6H2FN3O6 |
|---|---|
| Molecular Weight | 230.99 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 137.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 0 |
| Exact Mass | 230.99277 |
| Heavy Atoms | 16 |
| Complexity | 296.0 |
Chemical Identifiers
| CAS Number | 364-44-3 |
|---|---|
| SMILES | C1=C(C=C(C(=C1[N+](=O)[O-])F)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | XPARNGAWWCCOIM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
苦基氟 (CAS 364-44-3), with molecular formula C6H2FN3O6 and molecular weight 230.99 g/mol. IUPAC: 2-fluoro-1,3,5-trinitrobenzene.
Chemical Property Profile of 苦基氟
Property Insights of 苦基氟
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 苦基氟. The TPSA of 137.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 苦基氟. Following Lipinski's Rule of Five, 苦基氟 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 苦基氟?
The CAS number of 苦基氟 is 364-44-3.
What is the molecular formula of 苦基氟?
The molecular formula of 苦基氟 is C6H2FN3O6.
What is the molecular weight of 苦基氟?
The molecular weight of 苦基氟 is 230.99 g/mol.
Where can I buy 苦基氟?
You can request a quote for 苦基氟 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 苦基氟?
Yes, KEHONG BIO provides custom synthesis services for 苦基氟 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.