N-(2-carboxyethyl)-beta-alanine
TL;DR: N-(2-carboxyethyl)-beta-alanine (CAS 505-47-5) is a chemical compound with molecular formula C6H11NO4 and molecular weight 161.0688 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(2-carboxyethylamino)propanoic acid
Also Known As: 3,3'-Iminodipropionic acid, 3,3'-Azanediyldipropanoic acid, 3,3-Bis(N,N-dipropanoic acid), 3-(2-carboxyethylamino)propanoic acid, aminodipropionic acid
Application Areas
Top 5 of 21 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C6H11NO4 |
| Molecular Weight | 161.0688 g/mol |
| XLogP | -3.5 |
| Topological Polar Surface Area (TPSA) | 86.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 161.0688 Da |
| Heavy Atoms | 11 |
| Complexity | 130.0 |
| SMILES | C(CNCCC(=O)O)C(=O)O |
| InChIKey | TXPKUUXHNFRBPS-UHFFFAOYSA-N |
Product Description
Applications: N-(2-carboxyethyl)-beta-alanine is used in pharmaceutical synthesis routes and API production, as well as surfactant and detergent formulations. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
A pharmaceutical intermediate supplied by CoreyChem, N-(2-carboxyethyl)-beta-alanine (CAS 505-47-5) has the molecular formula C6H11NO4 and a molecular weight of 161.07 g/mol. Synonyms include 3,3'-Iminodipropionic acid and 3,3'-Azanediyldipropanoic acid.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of N-(2-carboxyethyl)-beta-alanine
Property Insights of N-(2-carboxyethyl)-beta-alanine
The XLogP value of -3.5 indicates that N-(2-carboxyethyl)-beta-alanine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 86.6 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2-carboxyethyl)-beta-alanine. Following Lipinski's Rule of Five, N-(2-carboxyethyl)-beta-alanine has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of N-(2-carboxyethyl)-beta-alanine?
The CAS number of N-(2-carboxyethyl)-beta-alanine is 505-47-5.
What is the molecular formula of N-(2-carboxyethyl)-beta-alanine?
The molecular formula of N-(2-carboxyethyl)-beta-alanine is C6H11NO4.
What is the molecular weight of N-(2-carboxyethyl)-beta-alanine?
The molecular weight of N-(2-carboxyethyl)-beta-alanine is 161.0688 g/mol.
What are the applications of N-(2-carboxyethyl)-beta-alanine?
N-(2-carboxyethyl)-beta-alanine is used in pharmaceutical synthesis routes and API production, as well as surfactant and detergent formulations. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg...
Where can I buy N-(2-carboxyethyl)-beta-alanine?
You can request a quote for N-(2-carboxyethyl)-beta-alanine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-(2-carboxyethyl)-beta-alanine?
Yes, CoreyChem provides custom synthesis services for N-(2-carboxyethyl)-beta-alanine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.