4-甲基-1,3-二硫杂环戊烷-2-酮
TL;DR: 4-甲基-1,3-二硫杂环戊烷-2-酮 (CAS 24632-92-6) is a chemical compound with molecular formula C4H6OS2 and molecular weight 133.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-甲基-1,3-二硫杂环戊烷-2-酮
4-methyl-1,3-dithiolan-2-one
Also Known As: 4-methyl-1,3-dithiolan-2-one, 1-Chlorobenzotriazole, Benzotriazole, 1-chloro-, 1,3-Dithiolan-2-one,4-methyl, 1,3-Dithiolan-2-one,4-methyl-
| Molecular Formula | C4H6OS2 |
|---|---|
| Molecular Weight | 133.99 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 67.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 133.98601 |
| Heavy Atoms | 7 |
| Complexity | 91.0 |
Chemical Identifiers
| CAS Number | 24632-92-6 |
|---|---|
| SMILES | CC1CSC(=O)S1 |
| InChIKey | DSLRLRPNJIGHLW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-甲基-1,3-二硫杂环戊烷-2-酮 (CAS 24632-92-6), with molecular formula C4H6OS2 and molecular weight 133.99 g/mol. IUPAC: 4-methyl-1,3-dithiolan-2-one.
Chemical Property Profile of 4-甲基-1,3-二硫杂环戊烷-2-酮
Property Insights of 4-甲基-1,3-二硫杂环戊烷-2-酮
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-甲基-1,3-二硫杂环戊烷-2-酮. The TPSA of 67.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-甲基-1,3-二硫杂环戊烷-2-酮. Following Lipinski's Rule of Five, 4-甲基-1,3-二硫杂环戊烷-2-酮 has 0 hydrogen bond donor(s) and 3 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 4-甲基-1,3-二硫杂环戊烷-2-酮?
The CAS number of 4-甲基-1,3-二硫杂环戊烷-2-酮 is 24632-92-6.
What is the molecular formula of 4-甲基-1,3-二硫杂环戊烷-2-酮?
The molecular formula of 4-甲基-1,3-二硫杂环戊烷-2-酮 is C4H6OS2.
What is the molecular weight of 4-甲基-1,3-二硫杂环戊烷-2-酮?
The molecular weight of 4-甲基-1,3-二硫杂环戊烷-2-酮 is 133.99 g/mol.
Where can I buy 4-甲基-1,3-二硫杂环戊烷-2-酮?
You can request a quote for 4-甲基-1,3-二硫杂环戊烷-2-酮 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-甲基-1,3-二硫杂环戊烷-2-酮?
Yes, KEHONG BIO provides custom synthesis services for 4-甲基-1,3-二硫杂环戊烷-2-酮 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.