4,6-Nonanedione, 2,8-dimethyl-5-(1,3-dithiol-2-ylidene)-
TL;DR: 4,6-Nonanedione, 2,8-dimethyl-5-(1,3-dithiol-2-ylidene)- (CAS 100673-03-8) is a chemical compound with molecular formula C14H20O2S2 and molecular weight 284.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(1,3-dithiol-2-ylidene)-2,8-dimethylnonane-4,6-dione
Also Known As: 2,8-Dimethyl-5-(1,3-dithiol-2-ylidene)-4,6-nonanedione, 4,6-Nonanedione, 2,8-dimethyl-5-(1,3-dithiol-2-ylidene)-, 5-(1,3-Dithiol-2-ylidene)-2,8-dimethyl-4,6-nonanedione, 3-(1,3-dithiol-2-ylidene)-2,4-pentanedione, 5-(1,3-dithiol-2-ylidene)-2,8-dimethylnonane-4,6-dione
| Molecular Formula | C14H20O2S2 |
|---|---|
| Molecular Weight | 284.09 g/mol |
| LogP | 4.3796 |
| Topological Polar Surface Area | 34.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 284.09048 |
| Heavy Atoms | 18 |
| Complexity | 358.59818 |
Chemical Identifiers
| CAS Number | 100673-03-8 |
|---|---|
| SMILES | CC(C)CC(=O)C(=C1SC=CS1)C(=O)CC(C)C |
Product Overview
4,6-Nonanedione, 2,8-dimethyl-5-(1,3-dithiol-2-ylidene)- (CAS 100673-03-8), with molecular formula C14H20O2S2 and molecular weight 284.09 g/mol. IUPAC: 5-(1,3-dithiol-2-ylidene)-2,8-dimethylnonane-4,6-dione.
Chemical Property Profile of 4,6-Nonanedione, 2,8-dimethyl-5-(1,3-dithiol-2-ylidene)-
Property Insights of 4,6-Nonanedione, 2,8-dimethyl-5-(1,3-dithiol-2-ylidene)-
The XLogP value of 4.3796 indicates that 4,6-Nonanedione, 2,8-dimethyl-5-(1,3-dithiol-2-ylidene)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.14 Ų, 4,6-Nonanedione, 2,8-dimethyl-5-(1,3-dithiol-2-ylidene)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,6-Nonanedione, 2,8-dimethyl-5-(1,3-dithiol-2-ylidene)- 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 4,6-Nonanedione, 2,8-dimethyl-5-(1,3-dithiol-2-ylidene)-?
The CAS number of 4,6-Nonanedione, 2,8-dimethyl-5-(1,3-dithiol-2-ylidene)- is 100673-03-8.
What is the molecular formula of 4,6-Nonanedione, 2,8-dimethyl-5-(1,3-dithiol-2-ylidene)-?
The molecular formula of 4,6-Nonanedione, 2,8-dimethyl-5-(1,3-dithiol-2-ylidene)- is C14H20O2S2.
What is the molecular weight of 4,6-Nonanedione, 2,8-dimethyl-5-(1,3-dithiol-2-ylidene)-?
The molecular weight of 4,6-Nonanedione, 2,8-dimethyl-5-(1,3-dithiol-2-ylidene)- is 284.09 g/mol.
Where can I buy 4,6-Nonanedione, 2,8-dimethyl-5-(1,3-dithiol-2-ylidene)-?
You can request a quote for 4,6-Nonanedione, 2,8-dimethyl-5-(1,3-dithiol-2-ylidene)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,6-Nonanedione, 2,8-dimethyl-5-(1,3-dithiol-2-ylidene)-?
Yes, KEHONG BIO provides custom synthesis services for 4,6-Nonanedione, 2,8-dimethyl-5-(1,3-dithiol-2-ylidene)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.