3,5-Bis(ethylamino)-1,2-dithiolium iodide
TL;DR: 3,5-Bis(ethylamino)-1,2-dithiolium iodide (CAS 28131-67-1) is a chemical compound with molecular formula C7H13IN2S2 and molecular weight 315.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl-[5-(ethylamino)dithiol-3-ylidene]azanium iodide
Also Known As: 3,5-Bis(ethylamino)-1,2-dithiolium iodide, 3,5-Bis(ethylamino)-1,2-dithiol-1-ium iodide, 1,2-DITHIOL-1-IUM, 3,5-BIS(ETHYLAMINO)-, IODIDE, ethyl-[5-(ethylamino)dithiol-3-ylidene]azanium iodide, (Z)-ethyl-[5-(ethylamino)dithiol-3-ylidene]azanium iodide
| Molecular Formula | C7H13IN2S2 |
|---|---|
| Molecular Weight | 315.96 g/mol |
| LogP | -2.75 |
| Topological Polar Surface Area | 76.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 315.95648 |
| Heavy Atoms | 12 |
| Complexity | 168.0 |
Chemical Identifiers
| CAS Number | 28131-67-1 |
|---|---|
| SMILES | CCNC1=CC(=[NH+]CC)SS1.[I-] |
| InChIKey | RRVHZYHSNVEERY-UHFFFAOYSA-N |
Product Overview
3,5-Bis(ethylamino)-1,2-dithiolium iodide (CAS 28131-67-1), with molecular formula C7H13IN2S2 and molecular weight 315.96 g/mol. IUPAC: ethyl-[5-(ethylamino)dithiol-3-ylidene]azanium iodide.
Chemical Property Profile of 3,5-Bis(ethylamino)-1,2-dithiolium iodide
Property Insights of 3,5-Bis(ethylamino)-1,2-dithiolium iodide
The XLogP value of -2.75 indicates that 3,5-Bis(ethylamino)-1,2-dithiolium iodide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 76.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,5-Bis(ethylamino)-1,2-dithiolium iodide. Following Lipinski's Rule of Five, 3,5-Bis(ethylamino)-1,2-dithiolium iodide has 2 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 3,5-Bis(ethylamino)-1,2-dithiolium iodide?
The CAS number of 3,5-Bis(ethylamino)-1,2-dithiolium iodide is 28131-67-1.
What is the molecular formula of 3,5-Bis(ethylamino)-1,2-dithiolium iodide?
The molecular formula of 3,5-Bis(ethylamino)-1,2-dithiolium iodide is C7H13IN2S2.
What is the molecular weight of 3,5-Bis(ethylamino)-1,2-dithiolium iodide?
The molecular weight of 3,5-Bis(ethylamino)-1,2-dithiolium iodide is 315.96 g/mol.
Where can I buy 3,5-Bis(ethylamino)-1,2-dithiolium iodide?
You can request a quote for 3,5-Bis(ethylamino)-1,2-dithiolium iodide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5-Bis(ethylamino)-1,2-dithiolium iodide?
Yes, KEHONG BIO provides custom synthesis services for 3,5-Bis(ethylamino)-1,2-dithiolium iodide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.