3-Amino-N-(carboxycarbonyl)-L-alanine
TL;DR: 3-Amino-N-(carboxycarbonyl)-L-alanine (CAS 61277-72-3) is a chemical compound with molecular formula C5H8N2O5 and molecular weight 176.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-3-amino-2-(oxaloamino)propanoic acid
Also Known As: alpha-ODAP, BOAA, 3-Amino-N-oxaloalanine, 3-Amino-N-(carboxycarbonyl)-L-alanine, Oxalyldiaminopropionic acid
| Molecular Formula | C5H8N2O5 |
|---|---|
| Molecular Weight | 176.04 g/mol |
| LogP | -2.4009 |
| Topological Polar Surface Area | 129.72 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 176.04332 |
| Heavy Atoms | 12 |
| Complexity | 213.88412 |
Chemical Identifiers
| CAS Number | 61277-72-3 |
|---|---|
| SMILES | C([C@@H](C(=O)O)NC(=O)C(=O)O)N |
Product Overview
3-Amino-N-(carboxycarbonyl)-L-alanine (CAS 61277-72-3), with molecular formula C5H8N2O5 and molecular weight 176.04 g/mol. IUPAC: (2S)-3-amino-2-(oxaloamino)propanoic acid.
Chemical Property Profile of 3-Amino-N-(carboxycarbonyl)-L-alanine
Property Insights of 3-Amino-N-(carboxycarbonyl)-L-alanine
The XLogP value of -2.4009 indicates that 3-Amino-N-(carboxycarbonyl)-L-alanine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 129.72 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Amino-N-(carboxycarbonyl)-L-alanine. Following Lipinski's Rule of Five, 3-Amino-N-(carboxycarbonyl)-L-alanine has 4 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-Amino-N-(carboxycarbonyl)-L-alanine?
The CAS number of 3-Amino-N-(carboxycarbonyl)-L-alanine is 61277-72-3.
What is the molecular formula of 3-Amino-N-(carboxycarbonyl)-L-alanine?
The molecular formula of 3-Amino-N-(carboxycarbonyl)-L-alanine is C5H8N2O5.
What is the molecular weight of 3-Amino-N-(carboxycarbonyl)-L-alanine?
The molecular weight of 3-Amino-N-(carboxycarbonyl)-L-alanine is 176.04 g/mol.
Where can I buy 3-Amino-N-(carboxycarbonyl)-L-alanine?
You can request a quote for 3-Amino-N-(carboxycarbonyl)-L-alanine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Amino-N-(carboxycarbonyl)-L-alanine?
Yes, KEHONG BIO provides custom synthesis services for 3-Amino-N-(carboxycarbonyl)-L-alanine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.