O-(2,3,4,5,6-Pentafluorobenzyl)hydroxylamine hydrochloride
TL;DR: O-(2,3,4,5,6-Pentafluorobenzyl)hydroxylamine hydrochloride (CAS 57981-02-9) is a chemical compound with molecular formula C7H5ClF5NO and molecular weight 249.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
O-[(2,3,4,5,6-pentafluorophenyl)methyl]hydroxylamine;hydrochloride
Also Known As: Florox Reagent, O-(2,3,4,5,6-Pentafluorobenzyl)hydroxylamine hydrochloride, PFBHA, PFBHOX, PFBOA
| Molecular Formula | C7H5ClF5NO |
|---|---|
| Molecular Weight | 249.00 g/mol |
| LogP | 2.19 |
| Topological Polar Surface Area | 35.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 248.99799 |
| Heavy Atoms | 15 |
| Complexity | 179.0 |
Chemical Identifiers
| CAS Number | 57981-02-9 |
|---|---|
| SMILES | C(C1=C(C(=C(C(=C1F)F)F)F)F)ON.Cl |
| InChIKey | HVMVKNXIMUCYJA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
O-(2,3,4,5,6-Pentafluorobenzyl)hydroxylamine hydrochloride (CAS 57981-02-9), with molecular formula C7H5ClF5NO and molecular weight 249.00 g/mol. IUPAC: O-[(2,3,4,5,6-pentafluorophenyl)methyl]hydroxylamine;hydrochloride.
Chemical Property Profile of O-(2,3,4,5,6-Pentafluorobenzyl)hydroxylamine hydrochloride
Property Insights of O-(2,3,4,5,6-Pentafluorobenzyl)hydroxylamine hydrochloride
The XLogP value of 2.19 suggests moderate lipophilicity, balancing water solubility and membrane permeability for O-(2,3,4,5,6-Pentafluorobenzyl)hydroxylamine hydrochloride. With a topological polar surface area (TPSA) of 35.3 Ų, O-(2,3,4,5,6-Pentafluorobenzyl)hydroxylamine hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, O-(2,3,4,5,6-Pentafluorobenzyl)hydroxylamine hydrochloride has 2 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 O-(2,3,4,5,6-Pentafluorobenzyl)hydroxylamine hydrochloride?
The CAS number of O-(2,3,4,5,6-Pentafluorobenzyl)hydroxylamine hydrochloride is 57981-02-9.
What is the molecular formula of O-(2,3,4,5,6-Pentafluorobenzyl)hydroxylamine hydrochloride?
The molecular formula of O-(2,3,4,5,6-Pentafluorobenzyl)hydroxylamine hydrochloride is C7H5ClF5NO.
What is the molecular weight of O-(2,3,4,5,6-Pentafluorobenzyl)hydroxylamine hydrochloride?
The molecular weight of O-(2,3,4,5,6-Pentafluorobenzyl)hydroxylamine hydrochloride is 249.00 g/mol.
Where can I buy O-(2,3,4,5,6-Pentafluorobenzyl)hydroxylamine hydrochloride?
You can request a quote for O-(2,3,4,5,6-Pentafluorobenzyl)hydroxylamine hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for O-(2,3,4,5,6-Pentafluorobenzyl)hydroxylamine hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for O-(2,3,4,5,6-Pentafluorobenzyl)hydroxylamine hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.