(3S)-3-amino-3-(2,6-dichlorophenyl)propanoic acid
TL;DR: (3S)-3-amino-3-(2,6-dichlorophenyl)propanoic acid (CAS 1269960-51-1) is a chemical compound with molecular formula C9H9Cl2NO2 and molecular weight 233.00104 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3S)-3-amino-3-(2,6-dichlorophenyl)propanoic acid
Also Known As: (3S)-3-amino-3-(2,6-dichlorophenyl)propanoic acid, (S)-3-Amino-3-(2,6-dichlorophenyl)propanoicacid, (S)-3-Amino-3-(2,6-dichlorophenyl)propanoic acid, (3R)-3-amino-3-(2,6-dichlorophenyl)propanoic Acid, N14364
Technical Specifications
| Molecular Formula | C9H9Cl2NO2 |
| Molecular Weight | 233.00104 g/mol |
| XLogP | -0.1 |
| Topological Polar Surface Area (TPSA) | 67.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 233.00104 Da |
| Heavy Atoms | 14 |
| Complexity | 197.0 |
| SMILES | C1=CC(=C(C(=C1)Cl)[C@H](CC(=O)O)N)Cl |
| InChIKey | FJJTUPBXHKDPTC-ZETCQYMHSA-N |
Chemical Property Profile of (3S)-3-amino-3-(2,6-dichlorophenyl)propanoic acid
Property Insights of (3S)-3-amino-3-(2,6-dichlorophenyl)propanoic acid
The XLogP value of -0.1 indicates that (3S)-3-amino-3-(2,6-dichlorophenyl)propanoic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 67.8 Ų falls within the moderate polarity range, balancing permeability and solubility for (3S)-3-amino-3-(2,6-dichlorophenyl)propanoic acid. Following Lipinski's Rule of Five, (3S)-3-amino-3-(2,6-dichlorophenyl)propanoic acid has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of (3S)-3-amino-3-(2,6-dichlorophenyl)propanoic acid?
The CAS number of (3S)-3-amino-3-(2,6-dichlorophenyl)propanoic acid is 1269960-51-1.
What is the molecular formula of (3S)-3-amino-3-(2,6-dichlorophenyl)propanoic acid?
The molecular formula of (3S)-3-amino-3-(2,6-dichlorophenyl)propanoic acid is C9H9Cl2NO2.
What is the molecular weight of (3S)-3-amino-3-(2,6-dichlorophenyl)propanoic acid?
The molecular weight of (3S)-3-amino-3-(2,6-dichlorophenyl)propanoic acid is 233.00104 g/mol.
Where can I buy (3S)-3-amino-3-(2,6-dichlorophenyl)propanoic acid?
You can request a quote for (3S)-3-amino-3-(2,6-dichlorophenyl)propanoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (3S)-3-amino-3-(2,6-dichlorophenyl)propanoic acid?
Yes, CoreyChem provides custom synthesis services for (3S)-3-amino-3-(2,6-dichlorophenyl)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.