3,3'-Dithiobis(2,4-pentanedione)
TL;DR: 3,3'-Dithiobis(2,4-pentanedione) (CAS 36588-29-1) is a chemical compound with molecular formula C10H14O4S2 and molecular weight 262.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2,4-dioxopentan-3-yldisulfanyl)pentane-2,4-dione
Also Known As: 3,4-pentanedione), 3,3'-Dithiobis(2,4-pentanedione), 2, 3,3'-dithiobis-, 2, 3,3'-dithiodi-, 2,4-Pentanedione, 3, 3'-dithiodi-
| Molecular Formula | C10H14O4S2 |
|---|---|
| Molecular Weight | 262.03 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 119.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 262.03336 |
| Heavy Atoms | 16 |
| Complexity | 265.0 |
Chemical Identifiers
| CAS Number | 36588-29-1 |
|---|---|
| SMILES | CC(=O)C(C(=O)C)SSC(C(=O)C)C(=O)C |
| InChIKey | GSQAPNKAQDAFKO-UHFFFAOYSA-N |
Product Overview
3,3'-Dithiobis(2,4-pentanedione) (CAS 36588-29-1), with molecular formula C10H14O4S2 and molecular weight 262.03 g/mol. IUPAC: 3-(2,4-dioxopentan-3-yldisulfanyl)pentane-2,4-dione.
Chemical Property Profile of 3,3'-Dithiobis(2,4-pentanedione)
Property Insights of 3,3'-Dithiobis(2,4-pentanedione)
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,3'-Dithiobis(2,4-pentanedione). The TPSA of 119.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,3'-Dithiobis(2,4-pentanedione). Following Lipinski's Rule of Five, 3,3'-Dithiobis(2,4-pentanedione) has 0 hydrogen bond donor(s) and 6 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 3,3'-Dithiobis(2,4-pentanedione)?
The CAS number of 3,3'-Dithiobis(2,4-pentanedione) is 36588-29-1.
What is the molecular formula of 3,3'-Dithiobis(2,4-pentanedione)?
The molecular formula of 3,3'-Dithiobis(2,4-pentanedione) is C10H14O4S2.
What is the molecular weight of 3,3'-Dithiobis(2,4-pentanedione)?
The molecular weight of 3,3'-Dithiobis(2,4-pentanedione) is 262.03 g/mol.
Where can I buy 3,3'-Dithiobis(2,4-pentanedione)?
You can request a quote for 3,3'-Dithiobis(2,4-pentanedione) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3'-Dithiobis(2,4-pentanedione)?
Yes, KEHONG BIO provides custom synthesis services for 3,3'-Dithiobis(2,4-pentanedione) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.