(S)-3-Amino-4-(4-(trifluoromethyl)phenyl)butanoic acid hydrochloride
TL;DR: (S)-3-Amino-4-(4-(trifluoromethyl)phenyl)butanoic acid hydrochloride (CAS 332061-82-2) is a chemical compound with molecular formula C11H13ClF3NO2 and molecular weight 283.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S)-3-amino-4-[4-(trifluoromethyl)phenyl]butanoic acid;hydrochloride
Also Known As: (S)-3-Amino-4-(4-(trifluoromethyl)phenyl)butanoic acid hydrochloride, H-Phe(4-CF3)-OH HCl, H-beta-HPhe(4-CF3)-OH HCl, H-, A-HoPhe(4-CF3)-OH.HCl
| Molecular Formula | C11H13ClF3NO2 |
|---|---|
| Molecular Weight | 283.06 g/mol |
| LogP | 2.4717 |
| Topological Polar Surface Area | 63.32 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 283.0587 |
| Heavy Atoms | 18 |
| Complexity | 392.26996 |
Chemical Identifiers
| CAS Number | 332061-82-2 |
|---|---|
| SMILES | C1=CC(=CC=C1C[C@@H](CC(=O)O)N)C(F)(F)F.Cl |
Product Overview
(S)-3-Amino-4-(4-(trifluoromethyl)phenyl)butanoic acid hydrochloride (CAS 332061-82-2), with molecular formula C11H13ClF3NO2 and molecular weight 283.06 g/mol. IUPAC: (3S)-3-amino-4-[4-(trifluoromethyl)phenyl]butanoic acid;hydrochloride.
Chemical Property Profile of (S)-3-Amino-4-(4-(trifluoromethyl)phenyl)butanoic acid hydrochloride
Property Insights of (S)-3-Amino-4-(4-(trifluoromethyl)phenyl)butanoic acid hydrochloride
The XLogP value of 2.4717 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S)-3-Amino-4-(4-(trifluoromethyl)phenyl)butanoic acid hydrochloride. The TPSA of 63.32 Ų falls within the moderate polarity range, balancing permeability and solubility for (S)-3-Amino-4-(4-(trifluoromethyl)phenyl)butanoic acid hydrochloride. Following Lipinski's Rule of Five, (S)-3-Amino-4-(4-(trifluoromethyl)phenyl)butanoic acid hydrochloride has 2 hydrogen bond donor(s) and 2 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 (S)-3-Amino-4-(4-(trifluoromethyl)phenyl)butanoic acid hydrochloride?
The CAS number of (S)-3-Amino-4-(4-(trifluoromethyl)phenyl)butanoic acid hydrochloride is 332061-82-2.
What is the molecular formula of (S)-3-Amino-4-(4-(trifluoromethyl)phenyl)butanoic acid hydrochloride?
The molecular formula of (S)-3-Amino-4-(4-(trifluoromethyl)phenyl)butanoic acid hydrochloride is C11H13ClF3NO2.
What is the molecular weight of (S)-3-Amino-4-(4-(trifluoromethyl)phenyl)butanoic acid hydrochloride?
The molecular weight of (S)-3-Amino-4-(4-(trifluoromethyl)phenyl)butanoic acid hydrochloride is 283.06 g/mol.
Where can I buy (S)-3-Amino-4-(4-(trifluoromethyl)phenyl)butanoic acid hydrochloride?
You can request a quote for (S)-3-Amino-4-(4-(trifluoromethyl)phenyl)butanoic acid hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (S)-3-Amino-4-(4-(trifluoromethyl)phenyl)butanoic acid hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for (S)-3-Amino-4-(4-(trifluoromethyl)phenyl)butanoic acid hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.