Mercury(2-), bis(4-(dithiocarboxy)-1-piperazineacetato(2-))-, disodium structure

Mercury(2-), bis(4-(dithiocarboxy)-1-piperazineacetato(2-))-, disodium

TL;DR: Mercury(2-), bis(4-(dithiocarboxy)-1-piperazineacetato(2-))-, disodium (CAS 64046-01-1) is a chemical compound with molecular formula C14H20HgN4Na2O4S4 and molecular weight 683.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.

disodium;bis[[4-(carboxylatomethyl)piperazin-1-yl]sulfanylcarbothioyl]mercury

Also Known As: Sodium salt of mercury dithiocarbamate piperazine acetic acid, Mercury(2-), bis(4-(dithiocarboxy)-1-piperazineacetato(2-))-, disodium, disodium bis({[4-(carboxylatomethyl)piperazin-1-yl]sulfanyl}carbothioyl)mercury, disodium bis[[4-(2-oxido-2-oxoethyl)piperazin-1-yl]sulfanylcarbothioyl]mercury, RefChem:351988

CAS: 64046-01-1
Molecular Formula C14H20HgN4Na2O4S4
Molecular Weight 683.99 g/mol
LogP -8.32
Topological Polar Surface Area 208.0 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 12
Rotatable Bonds 6
Exact Mass 683.98694
Heavy Atoms 29
Complexity 510.0

Chemical Identifiers

CAS Number 64046-01-1
SMILES C1CN(CCN1CC(=O)[O-])SC(=S)[Hg]C(=S)SN2CCN(CC2)CC(=O)[O-].[Na+].[Na+]
InChIKey CLIRMVOIJHKNLJ-UHFFFAOYSA-L

Product Overview

Mercury(2-), bis(4-(dithiocarboxy)-1-piperazineacetato(2-))-, disodium (CAS 64046-01-1), with molecular formula C14H20HgN4Na2O4S4 and molecular weight 683.99 g/mol. IUPAC: disodium;bis[[4-(carboxylatomethyl)piperazin-1-yl]sulfanylcarbothioyl]mercury.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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Chemical Property Profile of Mercury(2-), bis(4-(dithiocarboxy)-1-piperazineacetato(2-))-, disodium

XLogP
-8.32
TPSA (Topological Polar Surface Area)
208.0
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
12
Rotatable Bonds
6
Heavy Atoms
29
Complexity
510.0
Exact Mass
683.98694
Monoisotopic Mass
683.98694
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of Mercury(2-), bis(4-(dithiocarboxy)-1-piperazineacetato(2-))-, disodium

The XLogP value of -8.32 indicates that Mercury(2-), bis(4-(dithiocarboxy)-1-piperazineacetato(2-))-, disodium is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 208.0 Ų indicates high polarity, suggesting Mercury(2-), bis(4-(dithiocarboxy)-1-piperazineacetato(2-))-, disodium may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Mercury(2-), bis(4-(dithiocarboxy)-1-piperazineacetato(2-))-, disodium has 0 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the typical lead time for this product?
Lead time typically ranges from 3-7 business days for in-stock items. For larger quantities or custom orders, please contact us for specific lead times.
Can you provide samples for testing?
Yes, we offer sample quantities for quality testing. Please submit an inquiry with your requirements and we will arrange samples accordingly.
What documentation do you provide with the product?
We provide COA (Certificate of Analysis), MSDS (Material Safety Data Sheet), and technical data sheets with each shipment.
Do you ship internationally?
Yes, we ship to most countries worldwide. Shipping costs and delivery times vary by location. Please contact us for specific shipping information.

Frequently Asked Questions

What is the CAS number of Mercury(2-), bis(4-(dithiocarboxy)-1-piperazineacetato(2-))-, disodium?

The CAS number of Mercury(2-), bis(4-(dithiocarboxy)-1-piperazineacetato(2-))-, disodium is 64046-01-1.

What is the molecular formula of Mercury(2-), bis(4-(dithiocarboxy)-1-piperazineacetato(2-))-, disodium?

The molecular formula of Mercury(2-), bis(4-(dithiocarboxy)-1-piperazineacetato(2-))-, disodium is C14H20HgN4Na2O4S4.

What is the molecular weight of Mercury(2-), bis(4-(dithiocarboxy)-1-piperazineacetato(2-))-, disodium?

The molecular weight of Mercury(2-), bis(4-(dithiocarboxy)-1-piperazineacetato(2-))-, disodium is 683.99 g/mol.

Where can I buy Mercury(2-), bis(4-(dithiocarboxy)-1-piperazineacetato(2-))-, disodium?

You can request a quote for Mercury(2-), bis(4-(dithiocarboxy)-1-piperazineacetato(2-))-, disodium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.

Does KEHONG BIO offer custom synthesis for Mercury(2-), bis(4-(dithiocarboxy)-1-piperazineacetato(2-))-, disodium?

Yes, KEHONG BIO provides custom synthesis services for Mercury(2-), bis(4-(dithiocarboxy)-1-piperazineacetato(2-))-, disodium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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