![[6-(Phenoxymethyl)dithiin-3-yl]methanol structure](/static/products/165/165405-19-6.webp)
[6-(Phenoxymethyl)dithiin-3-yl]methanol
TL;DR: [6-(Phenoxymethyl)dithiin-3-yl]methanol (CAS 165405-19-6) is a chemical compound with molecular formula C12H12O2S2 and molecular weight 252.02788 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[6-(phenoxymethyl)dithiin-3-yl]methanol
Also Known As: [6-(phenoxymethyl)dithiin-3-yl]methanol|1,2-Dithiin-3-methanol, 6-(phenoxymethyl)-|[6-(phenoxymethyl)-1,2-dithiin-3-yl]methanol|6-[[Phenyloxy]methyl]-1,2-dithiin-3-methanol|[6-(Phenoxymethyl)-1,2-dithiin-3-yl]methan-1-ol|CHEMBL329564
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C12H12O2S2 |
| Molecular Weight | 252.02788 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 80.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 252.02788 Da |
| Heavy Atoms | 16 |
| Complexity | 281.0 |
| SMILES | C1=CC=C(C=C1)OCC2=CC=C(SS2)CO |
| InChIKey | QDPSFUSEHYJTMT-UHFFFAOYSA-N |
Chemical Property Profile of [6-(Phenoxymethyl)dithiin-3-yl]methanol
Property Insights of [6-(Phenoxymethyl)dithiin-3-yl]methanol
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [6-(Phenoxymethyl)dithiin-3-yl]methanol. The TPSA of 80.1 Ų falls within the moderate polarity range, balancing permeability and solubility for [6-(Phenoxymethyl)dithiin-3-yl]methanol. Following Lipinski's Rule of Five, [6-(Phenoxymethyl)dithiin-3-yl]methanol has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of [6-(Phenoxymethyl)dithiin-3-yl]methanol?
The CAS number of [6-(Phenoxymethyl)dithiin-3-yl]methanol is 165405-19-6.
What is the molecular formula of [6-(Phenoxymethyl)dithiin-3-yl]methanol?
The molecular formula of [6-(Phenoxymethyl)dithiin-3-yl]methanol is C12H12O2S2.
What is the molecular weight of [6-(Phenoxymethyl)dithiin-3-yl]methanol?
The molecular weight of [6-(Phenoxymethyl)dithiin-3-yl]methanol is 252.02788 g/mol.
Where can I buy [6-(Phenoxymethyl)dithiin-3-yl]methanol?
You can request a quote for [6-(Phenoxymethyl)dithiin-3-yl]methanol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for [6-(Phenoxymethyl)dithiin-3-yl]methanol?
Yes, CoreyChem provides custom synthesis services for [6-(Phenoxymethyl)dithiin-3-yl]methanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.