![(2S)-2-azaniumyl-3-[4-(trifluoromethyl)phenyl]propanoate structure](/static/products/383/3832-75-5.png)
(2S)-2-azaniumyl-3-[4-(trifluoromethyl)phenyl]propanoate
TL;DR: (2S)-2-azaniumyl-3-[4-(trifluoromethyl)phenyl]propanoate (CAS 3832-75-5) is a chemical compound with molecular formula C10H10F3NO2 and molecular weight 233.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-azaniumyl-3-[4-(trifluoromethyl)phenyl]propanoate
Also Known As: (2S)-2-amino-3-[4-(trifluoromethyl)phenyl]propanoic acid, (2S)-2-azaniumyl-3-[4-(trifluoromethyl)phenyl]propanoate
| Molecular Formula | C10H10F3NO2 |
|---|---|
| Molecular Weight | 233.07 g/mol |
| LogP | -0.3917 |
| Topological Polar Surface Area | 67.77 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 233.06636 |
| Heavy Atoms | 16 |
| Complexity | 372.6457 |
Chemical Identifiers
| CAS Number | 3832-75-5 |
|---|---|
| SMILES | C1=CC(=CC=C1C[C@@H](C(=O)[O-])[NH3+])C(F)(F)F |
Product Overview
(2S)-2-azaniumyl-3-[4-(trifluoromethyl)phenyl]propanoate (CAS 3832-75-5), with molecular formula C10H10F3NO2 and molecular weight 233.07 g/mol. IUPAC: (2S)-2-azaniumyl-3-[4-(trifluoromethyl)phenyl]propanoate.
Chemical Property Profile of (2S)-2-azaniumyl-3-[4-(trifluoromethyl)phenyl]propanoate
Property Insights of (2S)-2-azaniumyl-3-[4-(trifluoromethyl)phenyl]propanoate
The XLogP value of -0.3917 indicates that (2S)-2-azaniumyl-3-[4-(trifluoromethyl)phenyl]propanoate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 67.77 Ų falls within the moderate polarity range, balancing permeability and solubility for (2S)-2-azaniumyl-3-[4-(trifluoromethyl)phenyl]propanoate. Following Lipinski's Rule of Five, (2S)-2-azaniumyl-3-[4-(trifluoromethyl)phenyl]propanoate 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
Frequently Asked Questions
What is the CAS number of (2S)-2-azaniumyl-3-[4-(trifluoromethyl)phenyl]propanoate?
The CAS number of (2S)-2-azaniumyl-3-[4-(trifluoromethyl)phenyl]propanoate is 3832-75-5.
What is the molecular formula of (2S)-2-azaniumyl-3-[4-(trifluoromethyl)phenyl]propanoate?
The molecular formula of (2S)-2-azaniumyl-3-[4-(trifluoromethyl)phenyl]propanoate is C10H10F3NO2.
What is the molecular weight of (2S)-2-azaniumyl-3-[4-(trifluoromethyl)phenyl]propanoate?
The molecular weight of (2S)-2-azaniumyl-3-[4-(trifluoromethyl)phenyl]propanoate is 233.07 g/mol.
Where can I buy (2S)-2-azaniumyl-3-[4-(trifluoromethyl)phenyl]propanoate?
You can request a quote for (2S)-2-azaniumyl-3-[4-(trifluoromethyl)phenyl]propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2S)-2-azaniumyl-3-[4-(trifluoromethyl)phenyl]propanoate?
Yes, KEHONG BIO provides custom synthesis services for (2S)-2-azaniumyl-3-[4-(trifluoromethyl)phenyl]propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.