3-(1,3-Dithiolan-2-ylidene)-2,4-pentanedione
TL;DR: 3-(1,3-Dithiolan-2-ylidene)-2,4-pentanedione (CAS 2183-30-4) is a chemical compound with molecular formula C8H10O2S2 and molecular weight 202.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1,3-dithiolan-2-ylidene)pentane-2,4-dione
Also Known As: 2-Diacetylmethylen-1,3-dithiolan, 3-(1,3-dithiolan-2-ylidene)-2,4-pentanedione, 3-(1,3-dithiolan-2-ylidene)pentane-2,4-dione, 2-(1-Acetyl-2-oxopropylidene)-1,3-dithiolane, 3-(1,3-Dithiolane-2-ylidene)-2,4-pentanedione
| Molecular Formula | C8H10O2S2 |
|---|---|
| Molecular Weight | 202.01 g/mol |
| LogP | 1.856 |
| Topological Polar Surface Area | 34.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 202.01222 |
| Heavy Atoms | 12 |
| Complexity | 231.78348 |
Chemical Identifiers
| CAS Number | 2183-30-4 |
|---|---|
| SMILES | CC(=O)C(=C1SCCS1)C(=O)C |
Product Overview
3-(1,3-Dithiolan-2-ylidene)-2,4-pentanedione (CAS 2183-30-4), with molecular formula C8H10O2S2 and molecular weight 202.01 g/mol. IUPAC: 3-(1,3-dithiolan-2-ylidene)pentane-2,4-dione.
Chemical Property Profile of 3-(1,3-Dithiolan-2-ylidene)-2,4-pentanedione
Property Insights of 3-(1,3-Dithiolan-2-ylidene)-2,4-pentanedione
The XLogP value of 1.856 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(1,3-Dithiolan-2-ylidene)-2,4-pentanedione. With a topological polar surface area (TPSA) of 34.14 Ų, 3-(1,3-Dithiolan-2-ylidene)-2,4-pentanedione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(1,3-Dithiolan-2-ylidene)-2,4-pentanedione 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 3-(1,3-Dithiolan-2-ylidene)-2,4-pentanedione?
The CAS number of 3-(1,3-Dithiolan-2-ylidene)-2,4-pentanedione is 2183-30-4.
What is the molecular formula of 3-(1,3-Dithiolan-2-ylidene)-2,4-pentanedione?
The molecular formula of 3-(1,3-Dithiolan-2-ylidene)-2,4-pentanedione is C8H10O2S2.
What is the molecular weight of 3-(1,3-Dithiolan-2-ylidene)-2,4-pentanedione?
The molecular weight of 3-(1,3-Dithiolan-2-ylidene)-2,4-pentanedione is 202.01 g/mol.
Where can I buy 3-(1,3-Dithiolan-2-ylidene)-2,4-pentanedione?
You can request a quote for 3-(1,3-Dithiolan-2-ylidene)-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-(1,3-Dithiolan-2-ylidene)-2,4-pentanedione?
Yes, KEHONG BIO provides custom synthesis services for 3-(1,3-Dithiolan-2-ylidene)-2,4-pentanedione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.