![3-Fluoro-2-[[6-(hydroxymethyl)dithiin-3-yl]methoxy]phenol structure](/static/products/172/172832-28-9.png)
3-Fluoro-2-[[6-(hydroxymethyl)dithiin-3-yl]methoxy]phenol
TL;DR: 3-Fluoro-2-[[6-(hydroxymethyl)dithiin-3-yl]methoxy]phenol (CAS 172832-28-9) is a chemical compound with molecular formula C12H11FO3S2 and molecular weight 286.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-fluoro-2-[[6-(hydroxymethyl)dithiin-3-yl]methoxy]phenol
Also Known As: 3-fluoro-2-[[6-(hydroxymethyl)dithiin-3-yl]methoxy]phenol, 3-fluoro-2-((6-(hydroxymethyl)-1,2-dithiin-3-yl)methoxy)phenol
| Molecular Formula | C12H11FO3S2 |
|---|---|
| Molecular Weight | 286.01 g/mol |
| LogP | 3.0652 |
| Topological Polar Surface Area | 49.69 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 286.01337 |
| Heavy Atoms | 18 |
| Complexity | 479.84595 |
Chemical Identifiers
| CAS Number | 172832-28-9 |
|---|---|
| SMILES | C1=CC(=C(C(=C1)F)OCC2=CC=C(SS2)CO)O |
Product Overview
3-Fluoro-2-[[6-(hydroxymethyl)dithiin-3-yl]methoxy]phenol (CAS 172832-28-9), with molecular formula C12H11FO3S2 and molecular weight 286.01 g/mol. IUPAC: 3-fluoro-2-[[6-(hydroxymethyl)dithiin-3-yl]methoxy]phenol.
Chemical Property Profile of 3-Fluoro-2-[[6-(hydroxymethyl)dithiin-3-yl]methoxy]phenol
Property Insights of 3-Fluoro-2-[[6-(hydroxymethyl)dithiin-3-yl]methoxy]phenol
The XLogP value of 3.0652 indicates that 3-Fluoro-2-[[6-(hydroxymethyl)dithiin-3-yl]methoxy]phenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.69 Ų, 3-Fluoro-2-[[6-(hydroxymethyl)dithiin-3-yl]methoxy]phenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Fluoro-2-[[6-(hydroxymethyl)dithiin-3-yl]methoxy]phenol has 2 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 3-Fluoro-2-[[6-(hydroxymethyl)dithiin-3-yl]methoxy]phenol?
The CAS number of 3-Fluoro-2-[[6-(hydroxymethyl)dithiin-3-yl]methoxy]phenol is 172832-28-9.
What is the molecular formula of 3-Fluoro-2-[[6-(hydroxymethyl)dithiin-3-yl]methoxy]phenol?
The molecular formula of 3-Fluoro-2-[[6-(hydroxymethyl)dithiin-3-yl]methoxy]phenol is C12H11FO3S2.
What is the molecular weight of 3-Fluoro-2-[[6-(hydroxymethyl)dithiin-3-yl]methoxy]phenol?
The molecular weight of 3-Fluoro-2-[[6-(hydroxymethyl)dithiin-3-yl]methoxy]phenol is 286.01 g/mol.
Where can I buy 3-Fluoro-2-[[6-(hydroxymethyl)dithiin-3-yl]methoxy]phenol?
You can request a quote for 3-Fluoro-2-[[6-(hydroxymethyl)dithiin-3-yl]methoxy]phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Fluoro-2-[[6-(hydroxymethyl)dithiin-3-yl]methoxy]phenol?
Yes, KEHONG BIO provides custom synthesis services for 3-Fluoro-2-[[6-(hydroxymethyl)dithiin-3-yl]methoxy]phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.