![Methyl [(propan-2-yl)disulfanyl]acetate structure](/static/products/922/92224-32-3.png)
Methyl [(propan-2-yl)disulfanyl]acetate
TL;DR: Methyl [(propan-2-yl)disulfanyl]acetate (CAS 92224-32-3) is a chemical compound with molecular formula C6H12O2S2 and molecular weight 180.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-(propan-2-yldisulfanyl)acetate
Also Known As: methyl(propan-2-yldisulfanyl)acetate, Methyl-5-methyl-3,4-dithiahexanoat, Methyl [(propan-2-yl)disulfanyl]acetate, methyl 2-(propan-2-yldisulfanyl)acetate, Benzoic acid,2-(2-ethoxy-2-oxoethoxy)-5-fluoro-,methyl ester
| Molecular Formula | C6H12O2S2 |
|---|---|
| Molecular Weight | 180.03 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 76.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 180.02788 |
| Heavy Atoms | 10 |
| Complexity | 104.0 |
Chemical Identifiers
| CAS Number | 92224-32-3 |
|---|---|
| SMILES | CC(C)SSCC(=O)OC |
| InChIKey | INRDRMCPWXCFJX-UHFFFAOYSA-N |
Product Overview
Methyl [(propan-2-yl)disulfanyl]acetate (CAS 92224-32-3), with molecular formula C6H12O2S2 and molecular weight 180.03 g/mol. IUPAC: methyl 2-(propan-2-yldisulfanyl)acetate.
Chemical Property Profile of Methyl [(propan-2-yl)disulfanyl]acetate
Property Insights of Methyl [(propan-2-yl)disulfanyl]acetate
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl [(propan-2-yl)disulfanyl]acetate. The TPSA of 76.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl [(propan-2-yl)disulfanyl]acetate. Following Lipinski's Rule of Five, Methyl [(propan-2-yl)disulfanyl]acetate has 0 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 Methyl [(propan-2-yl)disulfanyl]acetate?
The CAS number of Methyl [(propan-2-yl)disulfanyl]acetate is 92224-32-3.
What is the molecular formula of Methyl [(propan-2-yl)disulfanyl]acetate?
The molecular formula of Methyl [(propan-2-yl)disulfanyl]acetate is C6H12O2S2.
What is the molecular weight of Methyl [(propan-2-yl)disulfanyl]acetate?
The molecular weight of Methyl [(propan-2-yl)disulfanyl]acetate is 180.03 g/mol.
Where can I buy Methyl [(propan-2-yl)disulfanyl]acetate?
You can request a quote for Methyl [(propan-2-yl)disulfanyl]acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl [(propan-2-yl)disulfanyl]acetate?
Yes, KEHONG BIO provides custom synthesis services for Methyl [(propan-2-yl)disulfanyl]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.