Ammonium diethyldithiocarbamate
TL;DR: Ammonium diethyldithiocarbamate (CAS 21124-33-4) is a chemical compound with molecular formula C5H14N2S2 and molecular weight 166.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
azane;diethylcarbamodithioic acid
Also Known As: Ammonium diethyldithiocarbamate, azane;diethylcarbamodithioic acid, ammonium diethylcarbamodithioate, azane; diethylcarbamodithioic acid, (diethylamino)methanedithioic acid, N
| Molecular Formula | C5H14N2S2 |
|---|---|
| Molecular Weight | 166.06 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 166.05984 |
| Heavy Atoms | 9 |
| Complexity | 78.0 |
Chemical Identifiers
| CAS Number | 21124-33-4 |
|---|---|
| SMILES | CCN(CC)C(=S)S.N |
| InChIKey | JSYCNFYVINPILE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ammonium diethyldithiocarbamate (CAS 21124-33-4), with molecular formula C5H14N2S2 and molecular weight 166.06 g/mol. IUPAC: azane;diethylcarbamodithioic acid.
Chemical Property Profile of Ammonium diethyldithiocarbamate
Property Insights of Ammonium diethyldithiocarbamate
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ammonium diethyldithiocarbamate. With a topological polar surface area (TPSA) of 37.3 Ų, Ammonium diethyldithiocarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ammonium diethyldithiocarbamate has 2 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 Ammonium diethyldithiocarbamate?
The CAS number of Ammonium diethyldithiocarbamate is 21124-33-4.
What is the molecular formula of Ammonium diethyldithiocarbamate?
The molecular formula of Ammonium diethyldithiocarbamate is C5H14N2S2.
What is the molecular weight of Ammonium diethyldithiocarbamate?
The molecular weight of Ammonium diethyldithiocarbamate is 166.06 g/mol.
Where can I buy Ammonium diethyldithiocarbamate?
You can request a quote for Ammonium diethyldithiocarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ammonium diethyldithiocarbamate?
Yes, KEHONG BIO provides custom synthesis services for Ammonium diethyldithiocarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.