S-Benzyl O-ethyl carbonodithioate
TL;DR: S-Benzyl O-ethyl carbonodithioate (CAS 2943-26-2) is a chemical compound with molecular formula C10H12OS2 and molecular weight 212.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
O-ethyl benzylsulfanylmethanethioate
Also Known As: S-Benzyl O-ethyl carbonodithioate, benzyl ethoxydithioformate, O-ethyl S-benzyl xanthate, O-ethyl benzylsulfanylmethanethioate, (benzylsulfanyl)(ethoxy)methanethione
| Molecular Formula | C10H12OS2 |
|---|---|
| Molecular Weight | 212.03 g/mol |
| LogP | 3.2412 |
| Topological Polar Surface Area | 9.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 212.03296 |
| Heavy Atoms | 13 |
| Complexity | 258.8871 |
Chemical Identifiers
| CAS Number | 2943-26-2 |
|---|---|
| SMILES | CCOC(=S)SCC1=CC=CC=C1 |
Product Overview
S-Benzyl O-ethyl carbonodithioate (CAS 2943-26-2), with molecular formula C10H12OS2 and molecular weight 212.03 g/mol. IUPAC: O-ethyl benzylsulfanylmethanethioate.
Chemical Property Profile of S-Benzyl O-ethyl carbonodithioate
Property Insights of S-Benzyl O-ethyl carbonodithioate
The XLogP value of 3.2412 indicates that S-Benzyl O-ethyl carbonodithioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.23 Ų, S-Benzyl O-ethyl carbonodithioate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, S-Benzyl O-ethyl carbonodithioate has 0 hydrogen bond donor(s) and 3 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 S-Benzyl O-ethyl carbonodithioate?
The CAS number of S-Benzyl O-ethyl carbonodithioate is 2943-26-2.
What is the molecular formula of S-Benzyl O-ethyl carbonodithioate?
The molecular formula of S-Benzyl O-ethyl carbonodithioate is C10H12OS2.
What is the molecular weight of S-Benzyl O-ethyl carbonodithioate?
The molecular weight of S-Benzyl O-ethyl carbonodithioate is 212.03 g/mol.
Where can I buy S-Benzyl O-ethyl carbonodithioate?
You can request a quote for S-Benzyl O-ethyl carbonodithioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for S-Benzyl O-ethyl carbonodithioate?
Yes, KEHONG BIO provides custom synthesis services for S-Benzyl O-ethyl carbonodithioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.