Ethyl methylaminodithiocarbamate
TL;DR: Ethyl methylaminodithiocarbamate (CAS 52664-26-3) is a chemical compound with molecular formula C4H9NS2 and molecular weight 135.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl N-methylcarbamodithioate
Also Known As: Ethyl methylaminodithiocarbamate, ethyl N-methylcarbamodithioate, ethyl methylcarbamodithioate, N-Methyl(ethylsulfanyl)carbothioamide, Carbamodithioic acid, methyl-, ethyl ester
| Molecular Formula | C4H9NS2 |
|---|---|
| Molecular Weight | 135.02 g/mol |
| LogP | 1.2438 |
| Topological Polar Surface Area | 12.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 135.01764 |
| Heavy Atoms | 7 |
| Complexity | 62.710133 |
Chemical Identifiers
| CAS Number | 52664-26-3 |
|---|---|
| SMILES | CCSC(=S)NC |
Product Overview
Ethyl methylaminodithiocarbamate (CAS 52664-26-3), with molecular formula C4H9NS2 and molecular weight 135.02 g/mol. IUPAC: ethyl N-methylcarbamodithioate.
Chemical Property Profile of Ethyl methylaminodithiocarbamate
Property Insights of Ethyl methylaminodithiocarbamate
The XLogP value of 1.2438 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl methylaminodithiocarbamate. With a topological polar surface area (TPSA) of 12.03 Ų, Ethyl methylaminodithiocarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl methylaminodithiocarbamate has 1 hydrogen bond donor(s) and 2 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 Ethyl methylaminodithiocarbamate?
The CAS number of Ethyl methylaminodithiocarbamate is 52664-26-3.
What is the molecular formula of Ethyl methylaminodithiocarbamate?
The molecular formula of Ethyl methylaminodithiocarbamate is C4H9NS2.
What is the molecular weight of Ethyl methylaminodithiocarbamate?
The molecular weight of Ethyl methylaminodithiocarbamate is 135.02 g/mol.
Where can I buy Ethyl methylaminodithiocarbamate?
You can request a quote for Ethyl methylaminodithiocarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl methylaminodithiocarbamate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl methylaminodithiocarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.