Nitrilotripropionic acid
TL;DR: Nitrilotripropionic acid (CAS 817-11-8) is a chemical compound with molecular formula C9H15NO6 and molecular weight 233.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[bis(2-carboxyethyl)amino]propanoic acid
Also Known As: 3,3',3''-Nitrilotripropionic Acid, 3,3',3''-nitrilotripropanoic acid, NITRILOTRIPROPIONIC ACID, 3-[bis(2-carboxyethyl)amino]propanoic acid, 3,3,3-Nitrilotripropionic Acid
| Molecular Formula | C9H15NO6 |
|---|---|
| Molecular Weight | 233.09 g/mol |
| LogP | -3.5 |
| Topological Polar Surface Area | 115.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 233.08994 |
| Heavy Atoms | 16 |
| Complexity | 222.0 |
Chemical Identifiers
| CAS Number | 817-11-8 |
|---|---|
| SMILES | C(CN(CCC(=O)O)CCC(=O)O)C(=O)O |
| InChIKey | IWTIBPIVCKUAHK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 21 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Nitrilotripropionic acid (CAS 817-11-8), with molecular formula C9H15NO6 and molecular weight 233.09 g/mol. IUPAC: 3-[bis(2-carboxyethyl)amino]propanoic acid.
Chemical Property Profile of Nitrilotripropionic acid
Property Insights of Nitrilotripropionic acid
The XLogP value of -3.5 indicates that Nitrilotripropionic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 115.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Nitrilotripropionic acid. Following Lipinski's Rule of Five, Nitrilotripropionic acid has 3 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 Nitrilotripropionic acid?
The CAS number of Nitrilotripropionic acid is 817-11-8.
What is the molecular formula of Nitrilotripropionic acid?
The molecular formula of Nitrilotripropionic acid is C9H15NO6.
What is the molecular weight of Nitrilotripropionic acid?
The molecular weight of Nitrilotripropionic acid is 233.09 g/mol.
Where can I buy Nitrilotripropionic acid?
You can request a quote for Nitrilotripropionic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Nitrilotripropionic acid?
Yes, KEHONG BIO provides custom synthesis services for Nitrilotripropionic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.