1,2-二硫戊环-4,4-二甲醇
TL;DR: 1,2-二硫戊环-4,4-二甲醇 (CAS 1121-96-6) is a chemical compound with molecular formula C5H10O2S2 and molecular weight 166.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2-二硫戊环-4,4-二甲醇
[4-(hydroxymethyl)dithiolan-4-yl]methanol
Also Known As: 1,2-DITHIOLANE-4,4-DIMETHANOL, (1,2-dithiolane-4,4-diyl)dimethanol, 4,4-Bis-hydroxymethyl-1,2-dithiolane, NCIOpen2_000633, [4-(hydroxymethyl)dithiolan-4-yl]methanol
| Molecular Formula | C5H10O2S2 |
|---|---|
| Molecular Weight | 166.01 g/mol |
| LogP | -0.6 |
| Topological Polar Surface Area | 91.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 166.01222 |
| Heavy Atoms | 9 |
| Complexity | 85.0 |
Chemical Identifiers
| CAS Number | 1121-96-6 |
|---|---|
| SMILES | C1C(CSS1)(CO)CO |
| InChIKey | GEHRODWKNCVVJO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,2-二硫戊环-4,4-二甲醇 (CAS 1121-96-6), with molecular formula C5H10O2S2 and molecular weight 166.01 g/mol. IUPAC: [4-(hydroxymethyl)dithiolan-4-yl]methanol.
Chemical Property Profile of 1,2-二硫戊环-4,4-二甲醇
Property Insights of 1,2-二硫戊环-4,4-二甲醇
The XLogP value of -0.6 indicates that 1,2-二硫戊环-4,4-二甲醇 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 1,2-二硫戊环-4,4-二甲醇. Following Lipinski's Rule of Five, 1,2-二硫戊环-4,4-二甲醇 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 1,2-二硫戊环-4,4-二甲醇?
The CAS number of 1,2-二硫戊环-4,4-二甲醇 is 1121-96-6.
What is the molecular formula of 1,2-二硫戊环-4,4-二甲醇?
The molecular formula of 1,2-二硫戊环-4,4-二甲醇 is C5H10O2S2.
What is the molecular weight of 1,2-二硫戊环-4,4-二甲醇?
The molecular weight of 1,2-二硫戊环-4,4-二甲醇 is 166.01 g/mol.
Where can I buy 1,2-二硫戊环-4,4-二甲醇?
You can request a quote for 1,2-二硫戊环-4,4-二甲醇 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2-二硫戊环-4,4-二甲醇?
Yes, KEHONG BIO provides custom synthesis services for 1,2-二硫戊环-4,4-二甲醇 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.