Barium, ((ethylenedinitrilo)tetraacetato)cobaltate(III), tetrahydrate
TL;DR: Barium, ((ethylenedinitrilo)tetraacetato)cobaltate(III), tetrahydrate (CAS 49784-47-6) is a chemical compound with molecular formula C20H32BaCo2N4O20 and molecular weight 903.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
barium(2+);bis(2-[2-[bis(carboxylatomethyl)amino]ethyl-(carboxylatomethyl)amino]acetate);bis(cobalt(3+));tetrahydrate
Also Known As: Barium, ((ethylenedinitrilo)tetraacetato)cobaltate(III), tetrahydrate, Barium cobalt(3+) 2,2',2'',2'''-(ethane-1,2-diyldinitrilo)tetraacetate--water (1/2/2/4), barium(2+); 2-[2-[bis(2-oxido-2-oxoethyl)amino]ethyl-(2-oxido-2-oxoethyl)amino]acetate; cobalt(3+); tetrahydrate, Cobaltate(1-), [[N,N'-1,2-ethanediylbis[N-(carboxymethyl)glycinato]](4-)-N,N',O,O',ON,ON']-, barium (2:1), tetrahydrate, RefChem:320897
| Molecular Formula | C20H32BaCo2N4O20 |
|---|---|
| Molecular Weight | 903.93 g/mol |
| LogP | -18.5046 |
| Topological Polar Surface Area | 338.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 24 |
| Rotatable Bonds | 14 |
| Exact Mass | 903.9326 |
| Heavy Atoms | 47 |
| Complexity | 293.0 |
Chemical Identifiers
| CAS Number | 49784-47-6 |
|---|---|
| SMILES | C(CN(CC(=O)[O-])CC(=O)[O-])N(CC(=O)[O-])CC(=O)[O-].C(CN(CC(=O)[O-])CC(=O)[O-])N(CC(=O)[O-])CC(=O)[O-].O.O.O.O.[Co+3].[Co+3].[Ba+2] |
| InChIKey | LDVYHTFTNOSQOG-UHFFFAOYSA-F |
Product Overview
Barium, ((ethylenedinitrilo)tetraacetato)cobaltate(III), tetrahydrate (CAS 49784-47-6), with molecular formula C20H32BaCo2N4O20 and molecular weight 903.93 g/mol. IUPAC: barium(2+);bis(2-[2-[bis(carboxylatomethyl)amino]ethyl-(carboxylatomethyl)amino]acetate);bis(cobalt(3+));tetrahydrate.
Chemical Property Profile of Barium, ((ethylenedinitrilo)tetraacetato)cobaltate(III), tetrahydrate
Property Insights of Barium, ((ethylenedinitrilo)tetraacetato)cobaltate(III), tetrahydrate
The XLogP value of -18.5046 indicates that Barium, ((ethylenedinitrilo)tetraacetato)cobaltate(III), tetrahydrate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 338.0 Ų indicates high polarity, suggesting Barium, ((ethylenedinitrilo)tetraacetato)cobaltate(III), tetrahydrate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Barium, ((ethylenedinitrilo)tetraacetato)cobaltate(III), tetrahydrate has 4 hydrogen bond donor(s) and 24 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Barium, ((ethylenedinitrilo)tetraacetato)cobaltate(III), tetrahydrate?
The CAS number of Barium, ((ethylenedinitrilo)tetraacetato)cobaltate(III), tetrahydrate is 49784-47-6.
What is the molecular formula of Barium, ((ethylenedinitrilo)tetraacetato)cobaltate(III), tetrahydrate?
The molecular formula of Barium, ((ethylenedinitrilo)tetraacetato)cobaltate(III), tetrahydrate is C20H32BaCo2N4O20.
What is the molecular weight of Barium, ((ethylenedinitrilo)tetraacetato)cobaltate(III), tetrahydrate?
The molecular weight of Barium, ((ethylenedinitrilo)tetraacetato)cobaltate(III), tetrahydrate is 903.93 g/mol.
Where can I buy Barium, ((ethylenedinitrilo)tetraacetato)cobaltate(III), tetrahydrate?
You can request a quote for Barium, ((ethylenedinitrilo)tetraacetato)cobaltate(III), tetrahydrate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Barium, ((ethylenedinitrilo)tetraacetato)cobaltate(III), tetrahydrate?
Yes, KEHONG BIO provides custom synthesis services for Barium, ((ethylenedinitrilo)tetraacetato)cobaltate(III), tetrahydrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.