2-Amino-4-oxobutanoic acid
TL;DR: 2-Amino-4-oxobutanoic acid (CAS 15106-57-7) is a chemical compound with molecular formula C4H7NO3 and molecular weight 117.042595 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-amino-4-oxobutanoic acid
Also Known As: 2-amino-4-oxobutanoic acid, alanal, Aspartic semialdehyde, Aspartate semialdehyde, Aspartic beta semialdehyde
Application Areas
Top 5 of 9 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C4H7NO3 |
| Molecular Weight | 117.042595 g/mol |
| XLogP | -3.9 |
| Topological Polar Surface Area (TPSA) | 80.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 117.042595 Da |
| Heavy Atoms | 8 |
| Complexity | 101.0 |
| SMILES | C(C=O)C(C(=O)O)N |
| InChIKey | HOSWPDPVFBCLSY-UHFFFAOYSA-N |
Product Description
Applications: 2-Amino-4-oxobutanoic acid is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. 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, 2-Amino-4-oxobutanoic acid (CAS 15106-57-7) has the molecular formula C4H7NO3 and a molecular weight of 117.04 g/mol. Synonyms include 2-amino-4-oxobutanoic acid and alanal.
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 2-Amino-4-oxobutanoic acid
Property Insights of 2-Amino-4-oxobutanoic acid
The XLogP value of -3.9 indicates that 2-Amino-4-oxobutanoic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 80.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Amino-4-oxobutanoic acid. Following Lipinski's Rule of Five, 2-Amino-4-oxobutanoic acid has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-Amino-4-oxobutanoic acid?
The CAS number of 2-Amino-4-oxobutanoic acid is 15106-57-7.
What is the molecular formula of 2-Amino-4-oxobutanoic acid?
The molecular formula of 2-Amino-4-oxobutanoic acid is C4H7NO3.
What is the molecular weight of 2-Amino-4-oxobutanoic acid?
The molecular weight of 2-Amino-4-oxobutanoic acid is 117.042595 g/mol.
What are the applications of 2-Amino-4-oxobutanoic acid?
2-Amino-4-oxobutanoic acid is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item...
Where can I buy 2-Amino-4-oxobutanoic acid?
You can request a quote for 2-Amino-4-oxobutanoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Amino-4-oxobutanoic acid?
Yes, CoreyChem provides custom synthesis services for 2-Amino-4-oxobutanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.