Carboxymethyl ethylxanthate
TL;DR: Carboxymethyl ethylxanthate (CAS 25554-84-1) is a chemical compound with molecular formula C5H8O3S2 and molecular weight 179.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethoxycarbothioylsulfanylacetic acid
Also Known As: Carboxymethyl ethylxanthate, Ethyl xanthogeneacetic acid, [(ethoxycarbonothioyl)thio]acetic acid, 2-((Ethoxycarbonothioyl)thio)acetic acid, 2-ethoxycarbothioylsulfanylacetic acid
| Molecular Formula | C5H8O3S2 |
|---|---|
| Molecular Weight | 179.99 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 104.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 179.99149 |
| Heavy Atoms | 10 |
| Complexity | 135.0 |
Chemical Identifiers
| CAS Number | 25554-84-1 |
|---|---|
| SMILES | CCOC(=S)SCC(=O)O |
| InChIKey | CZLONQRTHUAGMG-UHFFFAOYSA-N |
Product Overview
Carboxymethyl ethylxanthate (CAS 25554-84-1), with molecular formula C5H8O3S2 and molecular weight 179.99 g/mol. IUPAC: 2-ethoxycarbothioylsulfanylacetic acid.
Chemical Property Profile of Carboxymethyl ethylxanthate
Property Insights of Carboxymethyl ethylxanthate
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Carboxymethyl ethylxanthate. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Carboxymethyl ethylxanthate. Following Lipinski's Rule of Five, Carboxymethyl ethylxanthate has 1 hydrogen bond donor(s) and 5 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 Carboxymethyl ethylxanthate?
The CAS number of Carboxymethyl ethylxanthate is 25554-84-1.
What is the molecular formula of Carboxymethyl ethylxanthate?
The molecular formula of Carboxymethyl ethylxanthate is C5H8O3S2.
What is the molecular weight of Carboxymethyl ethylxanthate?
The molecular weight of Carboxymethyl ethylxanthate is 179.99 g/mol.
Where can I buy Carboxymethyl ethylxanthate?
You can request a quote for Carboxymethyl ethylxanthate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carboxymethyl ethylxanthate?
Yes, KEHONG BIO provides custom synthesis services for Carboxymethyl ethylxanthate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.