Bis[(2-hydroxyethyl)dithiocarbamato-S,S']nickel
TL;DR: Bis[(2-hydroxyethyl)dithiocarbamato-S,S']nickel (CAS 52486-98-3) is a chemical compound with molecular formula C6H12N2NiO2S4 and molecular weight 329.91 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(N-(2-hydroxyethyl)carbamodithioate);nickel(2+)
Also Known As: EINECS 257-953-2, Bis((2-hydroxyethyl)dithiocarbamato-S,S')nickel, Bis[(2-hydroxyethyl)dithiocarbamato-S,S']nickel, N-(2-hydroxyethyl)carbamodithioate; nickel(2+), Nickel(2+) bis[(2-hydroxyethyl)carbamodithioate]
| Molecular Formula | C6H12N2NiO2S4 |
|---|---|
| Molecular Weight | 329.91 g/mol |
| LogP | -1.2023 |
| Topological Polar Surface Area | 64.52 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 329.9135 |
| Heavy Atoms | 15 |
| Complexity | 155.21088 |
Chemical Identifiers
| CAS Number | 52486-98-3 |
|---|---|
| SMILES | C(CO)NC(=S)[S-].C(CO)NC(=S)[S-].[Ni+2] |
Product Overview
Bis[(2-hydroxyethyl)dithiocarbamato-S,S']nickel (CAS 52486-98-3), with molecular formula C6H12N2NiO2S4 and molecular weight 329.91 g/mol. IUPAC: bis(N-(2-hydroxyethyl)carbamodithioate);nickel(2+).
Chemical Property Profile of Bis[(2-hydroxyethyl)dithiocarbamato-S,S']nickel
Property Insights of Bis[(2-hydroxyethyl)dithiocarbamato-S,S']nickel
The XLogP value of -1.2023 indicates that Bis[(2-hydroxyethyl)dithiocarbamato-S,S']nickel is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 64.52 Ų falls within the moderate polarity range, balancing permeability and solubility for Bis[(2-hydroxyethyl)dithiocarbamato-S,S']nickel. Following Lipinski's Rule of Five, Bis[(2-hydroxyethyl)dithiocarbamato-S,S']nickel has 4 hydrogen bond donor(s) and 6 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 Bis[(2-hydroxyethyl)dithiocarbamato-S,S']nickel?
The CAS number of Bis[(2-hydroxyethyl)dithiocarbamato-S,S']nickel is 52486-98-3.
What is the molecular formula of Bis[(2-hydroxyethyl)dithiocarbamato-S,S']nickel?
The molecular formula of Bis[(2-hydroxyethyl)dithiocarbamato-S,S']nickel is C6H12N2NiO2S4.
What is the molecular weight of Bis[(2-hydroxyethyl)dithiocarbamato-S,S']nickel?
The molecular weight of Bis[(2-hydroxyethyl)dithiocarbamato-S,S']nickel is 329.91 g/mol.
Where can I buy Bis[(2-hydroxyethyl)dithiocarbamato-S,S']nickel?
You can request a quote for Bis[(2-hydroxyethyl)dithiocarbamato-S,S']nickel directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bis[(2-hydroxyethyl)dithiocarbamato-S,S']nickel?
Yes, KEHONG BIO provides custom synthesis services for Bis[(2-hydroxyethyl)dithiocarbamato-S,S']nickel and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.