![3-[Bis(2-carboxyethyl)amino]benzoic acid structure](/static/products/162/162901-47-5.png)
3-[Bis(2-carboxyethyl)amino]benzoic acid
TL;DR: 3-[Bis(2-carboxyethyl)amino]benzoic acid (CAS 162901-47-5) is a chemical compound with molecular formula C13H15NO6 and molecular weight 281.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[bis(2-carboxyethyl)amino]benzoic acid
Also Known As: 3-[bis(2-carboxyethyl)amino]benzoic acid, 3,3'-((3-carboxyphenyl)azanediyl)dipropanoic acid, A2626/0111721, 3-[bis(2-carboxyethyl)amino]benzoic acid (non-preferred name)
| Molecular Formula | C13H15NO6 |
|---|---|
| Molecular Weight | 281.09 g/mol |
| LogP | 1.1406 |
| Topological Polar Surface Area | 115.14 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 281.08994 |
| Heavy Atoms | 20 |
| Complexity | 495.33777 |
Chemical Identifiers
| CAS Number | 162901-47-5 |
|---|---|
| SMILES | C1=CC(=CC(=C1)N(CCC(=O)O)CCC(=O)O)C(=O)O |
Product Overview
3-[Bis(2-carboxyethyl)amino]benzoic acid (CAS 162901-47-5), with molecular formula C13H15NO6 and molecular weight 281.09 g/mol. IUPAC: 3-[bis(2-carboxyethyl)amino]benzoic acid.
Chemical Property Profile of 3-[Bis(2-carboxyethyl)amino]benzoic acid
Property Insights of 3-[Bis(2-carboxyethyl)amino]benzoic acid
The XLogP value of 1.1406 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[Bis(2-carboxyethyl)amino]benzoic acid. The TPSA of 115.14 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[Bis(2-carboxyethyl)amino]benzoic acid. Following Lipinski's Rule of Five, 3-[Bis(2-carboxyethyl)amino]benzoic acid has 3 hydrogen bond donor(s) and 4 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 3-[Bis(2-carboxyethyl)amino]benzoic acid?
The CAS number of 3-[Bis(2-carboxyethyl)amino]benzoic acid is 162901-47-5.
What is the molecular formula of 3-[Bis(2-carboxyethyl)amino]benzoic acid?
The molecular formula of 3-[Bis(2-carboxyethyl)amino]benzoic acid is C13H15NO6.
What is the molecular weight of 3-[Bis(2-carboxyethyl)amino]benzoic acid?
The molecular weight of 3-[Bis(2-carboxyethyl)amino]benzoic acid is 281.09 g/mol.
Where can I buy 3-[Bis(2-carboxyethyl)amino]benzoic acid?
You can request a quote for 3-[Bis(2-carboxyethyl)amino]benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[Bis(2-carboxyethyl)amino]benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-[Bis(2-carboxyethyl)amino]benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.