Bis({[(butan-2-yl)carbamothioyl]sulfanyl})nickel structure

Bis({[(butan-2-yl)carbamothioyl]sulfanyl})nickel

TL;DR: Bis({[(butan-2-yl)carbamothioyl]sulfanyl})nickel (CAS 83779-98-0) is a chemical compound with molecular formula C10H20N2NiS4 and molecular weight 353.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.

bis(N-butan-2-ylcarbamodithioate);nickel(2+)

Also Known As: Bis({[(butan-2-yl)carbamothioyl]sulfanyl})nickel, N-butan-2-ylcarbamodithioate;nickel(2+), IUPAC: (butan-2-ylamino)methanedithioate; Nickel(+2) Cation

CAS: 83779-98-0
Molecular Formula C10H20N2NiS4
Molecular Weight 353.99 g/mol
LogP 2.4101
Topological Polar Surface Area 24.06 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 4
Rotatable Bonds 4
Exact Mass 353.98627
Heavy Atoms 17
Complexity 192.48257

Chemical Identifiers

CAS Number 83779-98-0
SMILES CCC(C)NC(=S)[S-].CCC(C)NC(=S)[S-].[Ni+2]

Product Overview

Bis({[(butan-2-yl)carbamothioyl]sulfanyl})nickel (CAS 83779-98-0), with molecular formula C10H20N2NiS4 and molecular weight 353.99 g/mol. IUPAC: bis(N-butan-2-ylcarbamodithioate);nickel(2+).

🧪
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 Bis({[(butan-2-yl)carbamothioyl]sulfanyl})nickel

XLogP
2.4101
TPSA (Topological Polar Surface Area)
24.06
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
4
Rotatable Bonds
4
Heavy Atoms
17
Complexity
192.48257
Exact Mass
353.98627
Monoisotopic Mass
353.98627
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 Bis({[(butan-2-yl)carbamothioyl]sulfanyl})nickel

The XLogP value of 2.4101 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bis({[(butan-2-yl)carbamothioyl]sulfanyl})nickel. With a topological polar surface area (TPSA) of 24.06 Ų, Bis({[(butan-2-yl)carbamothioyl]sulfanyl})nickel exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bis({[(butan-2-yl)carbamothioyl]sulfanyl})nickel has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

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 Bis({[(butan-2-yl)carbamothioyl]sulfanyl})nickel?

The CAS number of Bis({[(butan-2-yl)carbamothioyl]sulfanyl})nickel is 83779-98-0.

What is the molecular formula of Bis({[(butan-2-yl)carbamothioyl]sulfanyl})nickel?

The molecular formula of Bis({[(butan-2-yl)carbamothioyl]sulfanyl})nickel is C10H20N2NiS4.

What is the molecular weight of Bis({[(butan-2-yl)carbamothioyl]sulfanyl})nickel?

The molecular weight of Bis({[(butan-2-yl)carbamothioyl]sulfanyl})nickel is 353.99 g/mol.

Where can I buy Bis({[(butan-2-yl)carbamothioyl]sulfanyl})nickel?

You can request a quote for Bis({[(butan-2-yl)carbamothioyl]sulfanyl})nickel directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.

Does KEHONG BIO offer custom synthesis for Bis({[(butan-2-yl)carbamothioyl]sulfanyl})nickel?

Yes, KEHONG BIO provides custom synthesis services for Bis({[(butan-2-yl)carbamothioyl]sulfanyl})nickel and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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