beta-Aspartame
TL;DR: beta-Aspartame (CAS 22839-61-8) is a chemical compound with molecular formula C14H18N2O5 and molecular weight 294.12158 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-2-amino-4-[[(2S)-1-methoxy-1-oxo-3-phenylpropan-2-yl]amino]-4-oxobutanoic acid
Also Known As: Beta-Aspartame, Aspartame, beta-, Verrucarol, b-Aspartame, A-Aspartame
Application Areas
Top 5 of 9 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C14H18N2O5 |
| Molecular Weight | 294.12158 g/mol |
| XLogP | -2.7 |
| Topological Polar Surface Area (TPSA) | 119.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 294.12158 Da |
| Heavy Atoms | 21 |
| Complexity | 380.0 |
| SMILES | COC(=O)[C@H](CC1=CC=CC=C1)NC(=O)C[C@@H](C(=O)O)N |
| InChIKey | SHHIPKDJQYIJJF-QWRGUYRKSA-N |
Chemical Property Profile of beta-Aspartame
Property Insights of beta-Aspartame
The XLogP value of -2.7 indicates that beta-Aspartame is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 119.0 Ų falls within the moderate polarity range, balancing permeability and solubility for beta-Aspartame. Following Lipinski's Rule of Five, beta-Aspartame has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of beta-Aspartame?
The CAS number of beta-Aspartame is 22839-61-8.
What is the molecular formula of beta-Aspartame?
The molecular formula of beta-Aspartame is C14H18N2O5.
What is the molecular weight of beta-Aspartame?
The molecular weight of beta-Aspartame is 294.12158 g/mol.
Where can I buy beta-Aspartame?
You can request a quote for beta-Aspartame directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for beta-Aspartame?
Yes, CoreyChem provides custom synthesis services for beta-Aspartame and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.