2-Nitro-1-(pentafluorophenyl)ethanol
TL;DR: 2-Nitro-1-(pentafluorophenyl)ethanol (CAS 19282-52-1) is a chemical compound with molecular formula C8H4F5NO3 and molecular weight 257.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-nitro-1-(2,3,4,5,6-pentafluorophenyl)ethanol
Also Known As: 2-nitro-1-(pentafluorophenyl)ethanol, 2-Nitro-1-(pentafluorophenyl)ethan-1-ol, 1-pentafluorophenyl-2-nitroethanol, 2-nitro-1-(2,3,4,5,6-pentafluorophenyl)ethanol, Benzenemethanol,2,3,4,5,6-pentafluoro-a-(nitromethyl)-
| Molecular Formula | C8H4F5NO3 |
|---|---|
| Molecular Weight | 257.01 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 66.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 2 |
| Exact Mass | 257.01114 |
| Heavy Atoms | 17 |
| Complexity | 273.0 |
Chemical Identifiers
| CAS Number | 19282-52-1 |
|---|---|
| SMILES | C(C(C1=C(C(=C(C(=C1F)F)F)F)F)O)[N+](=O)[O-] |
| InChIKey | JATSBNOGFCYNOT-UHFFFAOYSA-N |
Product Overview
2-Nitro-1-(pentafluorophenyl)ethanol (CAS 19282-52-1), with molecular formula C8H4F5NO3 and molecular weight 257.01 g/mol. IUPAC: 2-nitro-1-(2,3,4,5,6-pentafluorophenyl)ethanol.
Chemical Property Profile of 2-Nitro-1-(pentafluorophenyl)ethanol
Property Insights of 2-Nitro-1-(pentafluorophenyl)ethanol
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Nitro-1-(pentafluorophenyl)ethanol. The TPSA of 66.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Nitro-1-(pentafluorophenyl)ethanol. Following Lipinski's Rule of Five, 2-Nitro-1-(pentafluorophenyl)ethanol has 1 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 2-Nitro-1-(pentafluorophenyl)ethanol?
The CAS number of 2-Nitro-1-(pentafluorophenyl)ethanol is 19282-52-1.
What is the molecular formula of 2-Nitro-1-(pentafluorophenyl)ethanol?
The molecular formula of 2-Nitro-1-(pentafluorophenyl)ethanol is C8H4F5NO3.
What is the molecular weight of 2-Nitro-1-(pentafluorophenyl)ethanol?
The molecular weight of 2-Nitro-1-(pentafluorophenyl)ethanol is 257.01 g/mol.
Where can I buy 2-Nitro-1-(pentafluorophenyl)ethanol?
You can request a quote for 2-Nitro-1-(pentafluorophenyl)ethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Nitro-1-(pentafluorophenyl)ethanol?
Yes, KEHONG BIO provides custom synthesis services for 2-Nitro-1-(pentafluorophenyl)ethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.