3-Amino-4,4,4-trifluorobutyric acid
TL;DR: 3-Amino-4,4,4-trifluorobutyric acid (CAS 151911-19-2) is a chemical compound with molecular formula C4H6F3NO2 and molecular weight 157.03506 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-amino-4,4,4-trifluorobutanoic acid
Also Known As: 3-Amino-4,4,4-trifluorobutyric acid, 3-amino-4,4,4-trifluorobutanoic acid, 3-(Trifluoromethyl)-beta-alanine, 4,4,4-Trifluoro-beta-homoalanine, (R)-3-Amino-4,4,4-trifluorobutyric acid
Application Areas
Top 5 of 7 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C4H6F3NO2 |
| Molecular Weight | 157.03506 g/mol |
| XLogP | -2.3 |
| Topological Polar Surface Area (TPSA) | 63.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 157.03506 Da |
| Heavy Atoms | 10 |
| Complexity | 133.0 |
| SMILES | C(C(C(F)(F)F)N)C(=O)O |
| InChIKey | XRXQOEWWPPJVII-UHFFFAOYSA-N |
Chemical Property Profile of 3-Amino-4,4,4-trifluorobutyric acid
Property Insights of 3-Amino-4,4,4-trifluorobutyric acid
The XLogP value of -2.3 indicates that 3-Amino-4,4,4-trifluorobutyric acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 63.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Amino-4,4,4-trifluorobutyric acid. Following Lipinski's Rule of Five, 3-Amino-4,4,4-trifluorobutyric acid has 2 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 3-Amino-4,4,4-trifluorobutyric acid?
The CAS number of 3-Amino-4,4,4-trifluorobutyric acid is 151911-19-2.
What is the molecular formula of 3-Amino-4,4,4-trifluorobutyric acid?
The molecular formula of 3-Amino-4,4,4-trifluorobutyric acid is C4H6F3NO2.
What is the molecular weight of 3-Amino-4,4,4-trifluorobutyric acid?
The molecular weight of 3-Amino-4,4,4-trifluorobutyric acid is 157.03506 g/mol.
Where can I buy 3-Amino-4,4,4-trifluorobutyric acid?
You can request a quote for 3-Amino-4,4,4-trifluorobutyric acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-Amino-4,4,4-trifluorobutyric acid?
Yes, CoreyChem provides custom synthesis services for 3-Amino-4,4,4-trifluorobutyric acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.