Sodium butyldithiocarbamate
TL;DR: Sodium butyldithiocarbamate (CAS 7495-75-2) is a chemical compound with molecular formula C5H10NNaS2 and molecular weight 171.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
sodium N-butylcarbamodithioate
Also Known As: Sodium butyldithiocarbamate, Sodium butylcarbamodithioate, sodium N-butylcarbamodithioate, EINECS 231-344-1, sodium n-butyl di-thiocarbamate
| Molecular Formula | C5H10NNaS2 |
|---|---|
| Molecular Weight | 171.02 g/mol |
| LogP | -1.7881 |
| Topological Polar Surface Area | 12.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 171.01524 |
| Heavy Atoms | 9 |
| Complexity | 77.358246 |
Chemical Identifiers
| CAS Number | 7495-75-2 |
|---|---|
| SMILES | CCCCNC(=S)[S-].[Na+] |
Product Overview
Sodium butyldithiocarbamate (CAS 7495-75-2), with molecular formula C5H10NNaS2 and molecular weight 171.02 g/mol. IUPAC: sodium N-butylcarbamodithioate.
Chemical Property Profile of Sodium butyldithiocarbamate
Property Insights of Sodium butyldithiocarbamate
The XLogP value of -1.7881 indicates that Sodium butyldithiocarbamate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 12.03 Ų, Sodium butyldithiocarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Sodium butyldithiocarbamate 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 Sodium butyldithiocarbamate?
The CAS number of Sodium butyldithiocarbamate is 7495-75-2.
What is the molecular formula of Sodium butyldithiocarbamate?
The molecular formula of Sodium butyldithiocarbamate is C5H10NNaS2.
What is the molecular weight of Sodium butyldithiocarbamate?
The molecular weight of Sodium butyldithiocarbamate is 171.02 g/mol.
Where can I buy Sodium butyldithiocarbamate?
You can request a quote for Sodium butyldithiocarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Sodium butyldithiocarbamate?
Yes, KEHONG BIO provides custom synthesis services for Sodium butyldithiocarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.