4-Nitro-2,6-di(1,1,2,2,2-pentafluoroethoxy)phenol
TL;DR: 4-Nitro-2,6-di(1,1,2,2,2-pentafluoroethoxy)phenol (CAS 52999-55-0) is a chemical compound with molecular formula C10H3F10NO5 and molecular weight 406.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-nitro-2,6-bis(1,1,2,2,2-pentafluoroethoxy)phenol
Also Known As: 4-nitro-2,6-di(1,1,2,2,2-pentafluoroethoxy)phenol, 4-nitro-2,6-bis(1,1,2,2,2-pentafluoroethoxy)phenol, 4-nitro-2,6-bis(pentafluoroethoxy)phenol
| Molecular Formula | C10H3F10NO5 |
|---|---|
| Molecular Weight | 406.99 g/mol |
| LogP | 4.3682 |
| Topological Polar Surface Area | 81.83 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 406.98517 |
| Heavy Atoms | 26 |
| Complexity | 649.41754 |
Chemical Identifiers
| CAS Number | 52999-55-0 |
|---|---|
| SMILES | C1=C(C=C(C(=C1OC(C(F)(F)F)(F)F)O)OC(C(F)(F)F)(F)F)[N+](=O)[O-] |
Product Overview
4-Nitro-2,6-di(1,1,2,2,2-pentafluoroethoxy)phenol (CAS 52999-55-0), with molecular formula C10H3F10NO5 and molecular weight 406.99 g/mol. IUPAC: 4-nitro-2,6-bis(1,1,2,2,2-pentafluoroethoxy)phenol.
Chemical Property Profile of 4-Nitro-2,6-di(1,1,2,2,2-pentafluoroethoxy)phenol
Property Insights of 4-Nitro-2,6-di(1,1,2,2,2-pentafluoroethoxy)phenol
The XLogP value of 4.3682 indicates that 4-Nitro-2,6-di(1,1,2,2,2-pentafluoroethoxy)phenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.83 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Nitro-2,6-di(1,1,2,2,2-pentafluoroethoxy)phenol. Following Lipinski's Rule of Five, 4-Nitro-2,6-di(1,1,2,2,2-pentafluoroethoxy)phenol has 1 hydrogen bond donor(s) and 5 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 4-Nitro-2,6-di(1,1,2,2,2-pentafluoroethoxy)phenol?
The CAS number of 4-Nitro-2,6-di(1,1,2,2,2-pentafluoroethoxy)phenol is 52999-55-0.
What is the molecular formula of 4-Nitro-2,6-di(1,1,2,2,2-pentafluoroethoxy)phenol?
The molecular formula of 4-Nitro-2,6-di(1,1,2,2,2-pentafluoroethoxy)phenol is C10H3F10NO5.
What is the molecular weight of 4-Nitro-2,6-di(1,1,2,2,2-pentafluoroethoxy)phenol?
The molecular weight of 4-Nitro-2,6-di(1,1,2,2,2-pentafluoroethoxy)phenol is 406.99 g/mol.
Where can I buy 4-Nitro-2,6-di(1,1,2,2,2-pentafluoroethoxy)phenol?
You can request a quote for 4-Nitro-2,6-di(1,1,2,2,2-pentafluoroethoxy)phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Nitro-2,6-di(1,1,2,2,2-pentafluoroethoxy)phenol?
Yes, KEHONG BIO provides custom synthesis services for 4-Nitro-2,6-di(1,1,2,2,2-pentafluoroethoxy)phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.