bis(4-decanoyl-5-methyl-2-phenyl-1H-pyrazol-3-one);nickel structure

bis(4-decanoyl-5-methyl-2-phenyl-1H-pyrazol-3-one);nickel

TL;DR: bis(4-decanoyl-5-methyl-2-phenyl-1H-pyrazol-3-one);nickel (CAS 56557-00-7) is a chemical compound with molecular formula C40H56N4NiO4 and molecular weight 714.37 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.

bis(4-decanoyl-5-methyl-2-phenyl-1H-pyrazol-3-one);nickel

Also Known As: Bis(2,4-dihydro-5-methyl-4-(1-oxodecyl)-2-phenyl-3H-pyrazol-3-onato-O,O')nickel, Bis[2,4-dihydro-5-methyl-4-(1-oxodecyl)-2-phenyl-3H-pyrazol-3-onato-O,O']nickel, Nickel, bis[2,4-dihydro-5-methyl-4-(1-oxodecyl)-2-phenyl-3H-pyrazol-3-onato-O,O']-, Nickel, bis(2,4-dihydro-5-methyl-4-(1-(oxo-kappaO)decyl)-2-phenyl-3H-pyrazol-3-onato-kappaO3)-, Nickel, bis[2,4-dihydro-5-methyl-4-[1-(oxo-.kappa.O)decyl]-2-phenyl-3H-pyrazol-3-onato-.kappa.O3]-

CAS: 56557-00-7
Molecular Formula C40H56N4NiO4
Molecular Weight 714.37 g/mol
LogP 9.59
Topological Polar Surface Area 98.8 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 6
Rotatable Bonds 20
Exact Mass 714.3655
Heavy Atoms 49
Complexity 1020.0

Chemical Identifiers

CAS Number 56557-00-7
SMILES CCCCCCCCCC(=O)C1=C(NN(C1=O)C2=CC=CC=C2)C.CCCCCCCCCC(=O)C1=C(NN(C1=O)C2=CC=CC=C2)C.[Ni]
InChIKey RVBHASBJVAMIGN-UHFFFAOYSA-N

Product Overview

bis(4-decanoyl-5-methyl-2-phenyl-1H-pyrazol-3-one);nickel (CAS 56557-00-7), with molecular formula C40H56N4NiO4 and molecular weight 714.37 g/mol. IUPAC: bis(4-decanoyl-5-methyl-2-phenyl-1H-pyrazol-3-one);nickel.

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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.
View MSDS →

Chemical Property Profile of bis(4-decanoyl-5-methyl-2-phenyl-1H-pyrazol-3-one);nickel

XLogP
9.59
TPSA (Topological Polar Surface Area)
98.8
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
6
Rotatable Bonds
20
Heavy Atoms
49
Complexity
1020.0
Exact Mass
714.3655
Monoisotopic Mass
714.3655
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(4-decanoyl-5-methyl-2-phenyl-1H-pyrazol-3-one);nickel

The XLogP value of 9.59 indicates that bis(4-decanoyl-5-methyl-2-phenyl-1H-pyrazol-3-one);nickel is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.8 Ų falls within the moderate polarity range, balancing permeability and solubility for bis(4-decanoyl-5-methyl-2-phenyl-1H-pyrazol-3-one);nickel. Following Lipinski's Rule of Five, bis(4-decanoyl-5-methyl-2-phenyl-1H-pyrazol-3-one);nickel has 2 hydrogen bond donor(s) and 6 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 bis(4-decanoyl-5-methyl-2-phenyl-1H-pyrazol-3-one);nickel?

The CAS number of bis(4-decanoyl-5-methyl-2-phenyl-1H-pyrazol-3-one);nickel is 56557-00-7.

What is the molecular formula of bis(4-decanoyl-5-methyl-2-phenyl-1H-pyrazol-3-one);nickel?

The molecular formula of bis(4-decanoyl-5-methyl-2-phenyl-1H-pyrazol-3-one);nickel is C40H56N4NiO4.

What is the molecular weight of bis(4-decanoyl-5-methyl-2-phenyl-1H-pyrazol-3-one);nickel?

The molecular weight of bis(4-decanoyl-5-methyl-2-phenyl-1H-pyrazol-3-one);nickel is 714.37 g/mol.

Where can I buy bis(4-decanoyl-5-methyl-2-phenyl-1H-pyrazol-3-one);nickel?

You can request a quote for bis(4-decanoyl-5-methyl-2-phenyl-1H-pyrazol-3-one);nickel directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.

Does KEHONG BIO offer custom synthesis for bis(4-decanoyl-5-methyl-2-phenyl-1H-pyrazol-3-one);nickel?

Yes, KEHONG BIO provides custom synthesis services for bis(4-decanoyl-5-methyl-2-phenyl-1H-pyrazol-3-one);nickel and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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