![[6-(Hydroxymethyl)dithiin-3-yl]methanol structure](/static/products/1556/155698-98-9.webp)
[6-(Hydroxymethyl)dithiin-3-yl]methanol
TL;DR: [6-(Hydroxymethyl)dithiin-3-yl]methanol (CAS 155698-98-9) is a chemical compound with molecular formula C6H8O2S2 and molecular weight 176.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[6-(hydroxymethyl)dithiin-3-yl]methanol
Also Known As: 1,2-Dithiin-3,6-dimethanol, 1,2-Dithiin-3,6-bismethanol, [6-(hydroxymethyl)dithiin-3-yl]methanol, 3,6-bis(hydroxymethyl)-1,2-dithiin, 3,6-[bis(hydroxymethyl)]-1,2-dithiin
| Molecular Formula | C6H8O2S2 |
|---|---|
| Molecular Weight | 176.00 g/mol |
| LogP | -0.3 |
| Topological Polar Surface Area | 91.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 175.99657 |
| Heavy Atoms | 10 |
| Complexity | 155.0 |
Chemical Identifiers
| CAS Number | 155698-98-9 |
|---|---|
| SMILES | C1=C(SSC(=C1)CO)CO |
| InChIKey | JDSODJFESVZCCR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
[6-(Hydroxymethyl)dithiin-3-yl]methanol (CAS 155698-98-9), with molecular formula C6H8O2S2 and molecular weight 176.00 g/mol. IUPAC: [6-(hydroxymethyl)dithiin-3-yl]methanol.
Chemical Property Profile of [6-(Hydroxymethyl)dithiin-3-yl]methanol
Property Insights of [6-(Hydroxymethyl)dithiin-3-yl]methanol
The XLogP value of -0.3 indicates that [6-(Hydroxymethyl)dithiin-3-yl]methanol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 91.1 Ų falls within the moderate polarity range, balancing permeability and solubility for [6-(Hydroxymethyl)dithiin-3-yl]methanol. Following Lipinski's Rule of Five, [6-(Hydroxymethyl)dithiin-3-yl]methanol has 2 hydrogen bond donor(s) and 4 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 [6-(Hydroxymethyl)dithiin-3-yl]methanol?
The CAS number of [6-(Hydroxymethyl)dithiin-3-yl]methanol is 155698-98-9.
What is the molecular formula of [6-(Hydroxymethyl)dithiin-3-yl]methanol?
The molecular formula of [6-(Hydroxymethyl)dithiin-3-yl]methanol is C6H8O2S2.
What is the molecular weight of [6-(Hydroxymethyl)dithiin-3-yl]methanol?
The molecular weight of [6-(Hydroxymethyl)dithiin-3-yl]methanol is 176.00 g/mol.
Where can I buy [6-(Hydroxymethyl)dithiin-3-yl]methanol?
You can request a quote for [6-(Hydroxymethyl)dithiin-3-yl]methanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [6-(Hydroxymethyl)dithiin-3-yl]methanol?
Yes, KEHONG BIO provides custom synthesis services for [6-(Hydroxymethyl)dithiin-3-yl]methanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.