Hexamethylenediaminetetraacetic acid
TL;DR: Hexamethylenediaminetetraacetic acid (CAS 1633-00-7) is a chemical compound with molecular formula C14H24N2O8 and molecular weight 348.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[6-[bis(carboxymethyl)amino]hexyl-(carboxymethyl)amino]acetic acid
Also Known As: 1,6-Diaminohexane-N,N,N',N'-tetraacetic acid, HDTA, Hexamethylenediaminetetraacetic acid, Glycine, N,N'-1,6-hexanediylbis[N-(carboxymethyl)-, 1,6-hexanediaminetetraacetic acid
| Molecular Formula | C14H24N2O8 |
|---|---|
| Molecular Weight | 348.15 g/mol |
| LogP | -4.5 |
| Topological Polar Surface Area | 156.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 15 |
| Exact Mass | 348.15326 |
| Heavy Atoms | 24 |
| Complexity | 368.0 |
Chemical Identifiers
| CAS Number | 1633-00-7 |
|---|---|
| SMILES | C(CCCN(CC(=O)O)CC(=O)O)CCN(CC(=O)O)CC(=O)O |
| InChIKey | YGDVXSDNEFDTGV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 18 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Hexamethylenediaminetetraacetic acid (CAS 1633-00-7), with molecular formula C14H24N2O8 and molecular weight 348.15 g/mol. IUPAC: 2-[6-[bis(carboxymethyl)amino]hexyl-(carboxymethyl)amino]acetic acid.
Chemical Property Profile of Hexamethylenediaminetetraacetic acid
Property Insights of Hexamethylenediaminetetraacetic acid
The XLogP value of -4.5 indicates that Hexamethylenediaminetetraacetic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 156.0 Ų indicates high polarity, suggesting Hexamethylenediaminetetraacetic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Hexamethylenediaminetetraacetic acid has 4 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 Hexamethylenediaminetetraacetic acid?
The CAS number of Hexamethylenediaminetetraacetic acid is 1633-00-7.
What is the molecular formula of Hexamethylenediaminetetraacetic acid?
The molecular formula of Hexamethylenediaminetetraacetic acid is C14H24N2O8.
What is the molecular weight of Hexamethylenediaminetetraacetic acid?
The molecular weight of Hexamethylenediaminetetraacetic acid is 348.15 g/mol.
Where can I buy Hexamethylenediaminetetraacetic acid?
You can request a quote for Hexamethylenediaminetetraacetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hexamethylenediaminetetraacetic acid?
Yes, KEHONG BIO provides custom synthesis services for Hexamethylenediaminetetraacetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.