alpha,alpha,alpha,alpha',alpha',alpha'-Hexafluoro-5-nitroxylene
TL;DR: alpha,alpha,alpha,alpha',alpha',alpha'-Hexafluoro-5-nitroxylene (CAS 328-75-6) is a chemical compound with molecular formula C8H3F6NO2 and molecular weight 259.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-nitro-3,5-bis(trifluoromethyl)benzene
Also Known As: 3,5-Bis(trifluoromethyl)nitrobenzene, 1-Nitro-3,5-bis(trifluoromethyl)benzene, 1,3-Bis(trifluoromethyl)-5-nitrobenzene, 3,5-di(Trifluoromethyl)nitrobenzene, 2,5-Bis nitrobenzene
| Molecular Formula | C8H3F6NO2 |
|---|---|
| Molecular Weight | 259.01 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 45.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 0 |
| Exact Mass | 259.0068 |
| Heavy Atoms | 17 |
| Complexity | 272.0 |
Chemical Identifiers
| CAS Number | 328-75-6 |
|---|---|
| SMILES | C1=C(C=C(C=C1C(F)(F)F)[N+](=O)[O-])C(F)(F)F |
| InChIKey | GMUWJDVVXLBMEZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
alpha,alpha,alpha,alpha',alpha',alpha'-Hexafluoro-5-nitroxylene (CAS 328-75-6), with molecular formula C8H3F6NO2 and molecular weight 259.01 g/mol. IUPAC: 1-nitro-3,5-bis(trifluoromethyl)benzene.
Chemical Property Profile of alpha,alpha,alpha,alpha',alpha',alpha'-Hexafluoro-5-nitroxylene
Property Insights of alpha,alpha,alpha,alpha',alpha',alpha'-Hexafluoro-5-nitroxylene
The XLogP value of 4.1 indicates that alpha,alpha,alpha,alpha',alpha',alpha'-Hexafluoro-5-nitroxylene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.8 Ų, alpha,alpha,alpha,alpha',alpha',alpha'-Hexafluoro-5-nitroxylene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, alpha,alpha,alpha,alpha',alpha',alpha'-Hexafluoro-5-nitroxylene has 0 hydrogen bond donor(s) and 8 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 alpha,alpha,alpha,alpha',alpha',alpha'-Hexafluoro-5-nitroxylene?
The CAS number of alpha,alpha,alpha,alpha',alpha',alpha'-Hexafluoro-5-nitroxylene is 328-75-6.
What is the molecular formula of alpha,alpha,alpha,alpha',alpha',alpha'-Hexafluoro-5-nitroxylene?
The molecular formula of alpha,alpha,alpha,alpha',alpha',alpha'-Hexafluoro-5-nitroxylene is C8H3F6NO2.
What is the molecular weight of alpha,alpha,alpha,alpha',alpha',alpha'-Hexafluoro-5-nitroxylene?
The molecular weight of alpha,alpha,alpha,alpha',alpha',alpha'-Hexafluoro-5-nitroxylene is 259.01 g/mol.
Where can I buy alpha,alpha,alpha,alpha',alpha',alpha'-Hexafluoro-5-nitroxylene?
You can request a quote for alpha,alpha,alpha,alpha',alpha',alpha'-Hexafluoro-5-nitroxylene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for alpha,alpha,alpha,alpha',alpha',alpha'-Hexafluoro-5-nitroxylene?
Yes, KEHONG BIO provides custom synthesis services for alpha,alpha,alpha,alpha',alpha',alpha'-Hexafluoro-5-nitroxylene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.