EDTA
TL;DR: EDTA (CAS 67840-47-5) is a chemical compound with molecular formula C10H14N2O8-2 and molecular weight 290.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-[carboxylatomethyl(carboxymethyl)amino]ethyl-(carboxymethyl)amino]acetate
Also Known As: EDTA, 2-[carboxymethyl-[2-[carboxymethyl-(2-oxido-2-oxoethyl)amino]ethyl]amino]acetate, 2,2'-{Ethane-1,2-diylbis[(carboxymethyl)azanediyl]}diacetate, 2,2'-{ethane-1,2-diylbis[(carboxymethyl)imino]}diacetate (non-preferred name), 2-[2-(carboxylatomethyl-(carboxymethyl)amino)ethyl-(carboxymethyl)amino]acetate
| Molecular Formula | C10H14N2O8-2 |
|---|---|
| Molecular Weight | 290.07 g/mol |
| LogP | -4.6 |
| Topological Polar Surface Area | 161.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 9 |
| Exact Mass | 290.075 |
| Heavy Atoms | 20 |
| Complexity | 336.0 |
Chemical Identifiers
| CAS Number | 67840-47-5 |
|---|---|
| SMILES | C(CN(CC(=O)O)CC(=O)[O-])N(CC(=O)O)CC(=O)[O-] |
| InChIKey | KCXVZYZYPLLWCC-UHFFFAOYSA-L |
Product Overview
EDTA (CAS 67840-47-5), with molecular formula C10H14N2O8-2 and molecular weight 290.07 g/mol. IUPAC: 2-[2-[carboxylatomethyl(carboxymethyl)amino]ethyl-(carboxymethyl)amino]acetate.
Chemical Property Profile of EDTA
Property Insights of EDTA
The XLogP value of -4.6 indicates that EDTA is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 161.0 Ų indicates high polarity, suggesting EDTA may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, EDTA has 2 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 EDTA?
The CAS number of EDTA is 67840-47-5.
What is the molecular formula of EDTA?
The molecular formula of EDTA is C10H14N2O8-2.
What is the molecular weight of EDTA?
The molecular weight of EDTA is 290.07 g/mol.
Where can I buy EDTA?
You can request a quote for EDTA directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for EDTA?
Yes, KEHONG BIO provides custom synthesis services for EDTA and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.