Diethyldithiocarbamic acid methanethiol
TL;DR: Diethyldithiocarbamic acid methanethiol (CAS 25264-32-8) is a chemical compound with molecular formula C6H13NS3 and molecular weight 195.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methylsulfanyl N,N-diethylcarbamodithioate
Also Known As: Dedcmt, Diethyldithiocarbamic acid methanethiol, Methyl-diethylamincarbotrithioat, Methyl-diethylaminocarbotrithioat, KST-1B2272
| Molecular Formula | C6H13NS3 |
|---|---|
| Molecular Weight | 195.02 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 85.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 195.02101 |
| Heavy Atoms | 10 |
| Complexity | 101.0 |
Chemical Identifiers
| CAS Number | 25264-32-8 |
|---|---|
| SMILES | CCN(CC)C(=S)SSC |
| InChIKey | KDSKYZOAVKDCNN-UHFFFAOYSA-N |
Product Overview
Diethyldithiocarbamic acid methanethiol (CAS 25264-32-8), with molecular formula C6H13NS3 and molecular weight 195.02 g/mol. IUPAC: methylsulfanyl N,N-diethylcarbamodithioate.
Chemical Property Profile of Diethyldithiocarbamic acid methanethiol
Property Insights of Diethyldithiocarbamic acid methanethiol
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diethyldithiocarbamic acid methanethiol. The TPSA of 85.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Diethyldithiocarbamic acid methanethiol. Following Lipinski's Rule of Five, Diethyldithiocarbamic acid methanethiol 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 Diethyldithiocarbamic acid methanethiol?
The CAS number of Diethyldithiocarbamic acid methanethiol is 25264-32-8.
What is the molecular formula of Diethyldithiocarbamic acid methanethiol?
The molecular formula of Diethyldithiocarbamic acid methanethiol is C6H13NS3.
What is the molecular weight of Diethyldithiocarbamic acid methanethiol?
The molecular weight of Diethyldithiocarbamic acid methanethiol is 195.02 g/mol.
Where can I buy Diethyldithiocarbamic acid methanethiol?
You can request a quote for Diethyldithiocarbamic acid methanethiol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyldithiocarbamic acid methanethiol?
Yes, KEHONG BIO provides custom synthesis services for Diethyldithiocarbamic acid methanethiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.