Calcium sodium nitrilotriacetate
TL;DR: Calcium sodium nitrilotriacetate (CAS 60034-45-9) is a chemical compound with molecular formula C6H6CaNNaO6 and molecular weight 250.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
calcium;sodium;2-[bis(carboxylatomethyl)amino]acetate
Also Known As: Sodium calcium nitrilotriacetate, calcium sodium nitrilotriacetate, Solanesyl pyrophosphate, Sodium (nitrilotriacetato)calciate, Calcium sodium nitrilotriacetic acid
| Molecular Formula | C6H6CaNNaO6 |
|---|---|
| Molecular Weight | 250.97 g/mol |
| LogP | -8.84 |
| Topological Polar Surface Area | 124.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 250.97188 |
| Heavy Atoms | 15 |
| Complexity | 171.0 |
Chemical Identifiers
| CAS Number | 60034-45-9 |
|---|---|
| SMILES | C(C(=O)[O-])N(CC(=O)[O-])CC(=O)[O-].[Na+].[Ca+2] |
| InChIKey | ATEKMIYHWFLUPG-UHFFFAOYSA-K |
Product Overview
Calcium sodium nitrilotriacetate (CAS 60034-45-9), with molecular formula C6H6CaNNaO6 and molecular weight 250.97 g/mol. IUPAC: calcium;sodium;2-[bis(carboxylatomethyl)amino]acetate.
Chemical Property Profile of Calcium sodium nitrilotriacetate
Property Insights of Calcium sodium nitrilotriacetate
The XLogP value of -8.84 indicates that Calcium sodium nitrilotriacetate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 124.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Calcium sodium nitrilotriacetate. Following Lipinski's Rule of Five, Calcium sodium nitrilotriacetate has 0 hydrogen bond donor(s) and 7 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 Calcium sodium nitrilotriacetate?
The CAS number of Calcium sodium nitrilotriacetate is 60034-45-9.
What is the molecular formula of Calcium sodium nitrilotriacetate?
The molecular formula of Calcium sodium nitrilotriacetate is C6H6CaNNaO6.
What is the molecular weight of Calcium sodium nitrilotriacetate?
The molecular weight of Calcium sodium nitrilotriacetate is 250.97 g/mol.
Where can I buy Calcium sodium nitrilotriacetate?
You can request a quote for Calcium sodium nitrilotriacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Calcium sodium nitrilotriacetate?
Yes, KEHONG BIO provides custom synthesis services for Calcium sodium nitrilotriacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.