RefChem:663672
TL;DR: RefChem:663672 (CAS 63451-33-2) is a chemical compound with molecular formula C14H18MgN2Na2O8 and molecular weight 412.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
magnesium;disodium;2-[[2-[bis(carboxylatomethyl)amino]cyclohexyl]-(carboxylatomethyl)amino]acetate
Also Known As: Cyclohexanediamine tetraacetic acid, Glycine, N,N'-1,2-cyclohexanediylbis[N-(carboxymethyl)-, magnesium sodium salt (1:1:2), Glycine, N,N'-1,2-cyclohexanediylbis(N-(carboxymethyl)-, magnesium sodium salt (1:1:2), MAGNESIUMSODIUM N,N'-1,2-CYCLOHEXANEDIYLBIS[N-(CARBOXYMETHYL)]GLYCINATE (1:2:1), Magnesiumsodium N,N'-1,2-cyclohexanediylbis(N-(carboxymethyl))glycinate (1:2:1)
| Molecular Formula | C14H18MgN2Na2O8 |
|---|---|
| Molecular Weight | 412.07 g/mol |
| LogP | -12.47 |
| Topological Polar Surface Area | 167.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 6 |
| Exact Mass | 412.0709 |
| Heavy Atoms | 27 |
| Complexity | 397.0 |
Chemical Identifiers
| CAS Number | 63451-33-2 |
|---|---|
| SMILES | C1CCC(C(C1)N(CC(=O)[O-])CC(=O)[O-])N(CC(=O)[O-])CC(=O)[O-].[Na+].[Na+].[Mg+2] |
| InChIKey | RNRKFHMTSMNMCO-UHFFFAOYSA-J |
Product Overview
RefChem:663672 (CAS 63451-33-2), with molecular formula C14H18MgN2Na2O8 and molecular weight 412.07 g/mol. IUPAC: magnesium;disodium;2-[[2-[bis(carboxylatomethyl)amino]cyclohexyl]-(carboxylatomethyl)amino]acetate.
Chemical Property Profile of RefChem:663672
Property Insights of RefChem:663672
The XLogP value of -12.47 indicates that RefChem:663672 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 167.0 Ų indicates high polarity, suggesting RefChem:663672 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:663672 has 0 hydrogen bond donor(s) and 10 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 RefChem:663672?
The CAS number of RefChem:663672 is 63451-33-2.
What is the molecular formula of RefChem:663672?
The molecular formula of RefChem:663672 is C14H18MgN2Na2O8.
What is the molecular weight of RefChem:663672?
The molecular weight of RefChem:663672 is 412.07 g/mol.
Where can I buy RefChem:663672?
You can request a quote for RefChem:663672 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:663672?
Yes, KEHONG BIO provides custom synthesis services for RefChem:663672 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.