Ethanaminium, N-1,3-dithiol-2-ylidene-2-ethoxy-N-methyl-2-oxo-, chloride
TL;DR: Ethanaminium, N-1,3-dithiol-2-ylidene-2-ethoxy-N-methyl-2-oxo-, chloride (CAS 105877-72-3) is a chemical compound with molecular formula C8H12ClNO2S2 and molecular weight 253.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-dithiol-2-ylidene-(2-ethoxy-2-oxoethyl)-methylazanium chloride
Also Known As: N-1,3-Dithiol-2-ylidene-2-ethoxy-N-methyl-2-oxoethanaminium chloride, Ethanaminium, N-1,3-dithiol-2-ylidene-2-ethoxy-N-methyl-2-oxo-, chloride, N-(1,3-Dithiol-2-ylidene)-N-methyl-N-ethoxycarbonylmethyl ammonium chloride, 1,3-dithiol-2-ylidene-(2-ethoxy-2-oxoethyl)-methylazanium chloride, 1,3-dithiol-2-ylidene-(2-ethoxy-2-oxoethyl)-methylazanium,chloride
| Molecular Formula | C8H12ClNO2S2 |
|---|---|
| Molecular Weight | 253.00 g/mol |
| LogP | -2.2213 |
| Topological Polar Surface Area | 29.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 252.9998 |
| Heavy Atoms | 14 |
| Complexity | 328.36542 |
Chemical Identifiers
| CAS Number | 105877-72-3 |
|---|---|
| SMILES | CCOC(=O)C[N+](=C1SC=CS1)C.[Cl-] |
Product Overview
Ethanaminium, N-1,3-dithiol-2-ylidene-2-ethoxy-N-methyl-2-oxo-, chloride (CAS 105877-72-3), with molecular formula C8H12ClNO2S2 and molecular weight 253.00 g/mol. IUPAC: 1,3-dithiol-2-ylidene-(2-ethoxy-2-oxoethyl)-methylazanium chloride.
Chemical Property Profile of Ethanaminium, N-1,3-dithiol-2-ylidene-2-ethoxy-N-methyl-2-oxo-, chloride
Property Insights of Ethanaminium, N-1,3-dithiol-2-ylidene-2-ethoxy-N-methyl-2-oxo-, chloride
The XLogP value of -2.2213 indicates that Ethanaminium, N-1,3-dithiol-2-ylidene-2-ethoxy-N-methyl-2-oxo-, chloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 29.31 Ų, Ethanaminium, N-1,3-dithiol-2-ylidene-2-ethoxy-N-methyl-2-oxo-, chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethanaminium, N-1,3-dithiol-2-ylidene-2-ethoxy-N-methyl-2-oxo-, chloride 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 Ethanaminium, N-1,3-dithiol-2-ylidene-2-ethoxy-N-methyl-2-oxo-, chloride?
The CAS number of Ethanaminium, N-1,3-dithiol-2-ylidene-2-ethoxy-N-methyl-2-oxo-, chloride is 105877-72-3.
What is the molecular formula of Ethanaminium, N-1,3-dithiol-2-ylidene-2-ethoxy-N-methyl-2-oxo-, chloride?
The molecular formula of Ethanaminium, N-1,3-dithiol-2-ylidene-2-ethoxy-N-methyl-2-oxo-, chloride is C8H12ClNO2S2.
What is the molecular weight of Ethanaminium, N-1,3-dithiol-2-ylidene-2-ethoxy-N-methyl-2-oxo-, chloride?
The molecular weight of Ethanaminium, N-1,3-dithiol-2-ylidene-2-ethoxy-N-methyl-2-oxo-, chloride is 253.00 g/mol.
Where can I buy Ethanaminium, N-1,3-dithiol-2-ylidene-2-ethoxy-N-methyl-2-oxo-, chloride?
You can request a quote for Ethanaminium, N-1,3-dithiol-2-ylidene-2-ethoxy-N-methyl-2-oxo-, chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethanaminium, N-1,3-dithiol-2-ylidene-2-ethoxy-N-methyl-2-oxo-, chloride?
Yes, KEHONG BIO provides custom synthesis services for Ethanaminium, N-1,3-dithiol-2-ylidene-2-ethoxy-N-methyl-2-oxo-, chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.