![3-[[6-(Hydroxymethyl)dithiin-3-yl]methoxy]phenol structure](/static/products/165/165405-24-3.webp)
3-[[6-(Hydroxymethyl)dithiin-3-yl]methoxy]phenol
TL;DR: 3-[[6-(Hydroxymethyl)dithiin-3-yl]methoxy]phenol (CAS 165405-24-3) is a chemical compound with molecular formula C12H12O3S2 and molecular weight 268.0228 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[[6-(hydroxymethyl)dithiin-3-yl]methoxy]phenol
Also Known As: 3-[[6-(hydroxymethyl)dithiin-3-yl]methoxy]phenol, 1,2-Dithiin-3-methanol, 6-[(3-hydroxyphenoxy)methyl]-, 3-{[6-(hydroxymethyl)-1,2-dithiin-3-yl]methoxy}phenol, 6-[[(3-Hydroxyphenyl)oxy]methyl]-1,2-dithiin-3-methanol, (6-{[3-(Hydroxyamino)phenoxy]methyl}-1,2-dithiin-3-yl)methan-1-ol
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C12H12O3S2 |
| Molecular Weight | 268.0228 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 100.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 268.0228 Da |
| Heavy Atoms | 17 |
| Complexity | 315.0 |
| SMILES | C1=CC(=CC(=C1)OCC2=CC=C(SS2)CO)O |
| InChIKey | QCISXVWCTVLRPR-UHFFFAOYSA-N |
Chemical Property Profile of 3-[[6-(Hydroxymethyl)dithiin-3-yl]methoxy]phenol
Property Insights of 3-[[6-(Hydroxymethyl)dithiin-3-yl]methoxy]phenol
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[[6-(Hydroxymethyl)dithiin-3-yl]methoxy]phenol. The TPSA of 100.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[[6-(Hydroxymethyl)dithiin-3-yl]methoxy]phenol. Following Lipinski's Rule of Five, 3-[[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
What is the CAS number of 3-[[6-(Hydroxymethyl)dithiin-3-yl]methoxy]phenol?
The CAS number of 3-[[6-(Hydroxymethyl)dithiin-3-yl]methoxy]phenol is 165405-24-3.
What is the molecular formula of 3-[[6-(Hydroxymethyl)dithiin-3-yl]methoxy]phenol?
The molecular formula of 3-[[6-(Hydroxymethyl)dithiin-3-yl]methoxy]phenol is C12H12O3S2.
What is the molecular weight of 3-[[6-(Hydroxymethyl)dithiin-3-yl]methoxy]phenol?
The molecular weight of 3-[[6-(Hydroxymethyl)dithiin-3-yl]methoxy]phenol is 268.0228 g/mol.
Where can I buy 3-[[6-(Hydroxymethyl)dithiin-3-yl]methoxy]phenol?
You can request a quote for 3-[[6-(Hydroxymethyl)dithiin-3-yl]methoxy]phenol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-[[6-(Hydroxymethyl)dithiin-3-yl]methoxy]phenol?
Yes, CoreyChem provides custom synthesis services for 3-[[6-(Hydroxymethyl)dithiin-3-yl]methoxy]phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.