3-Hydroxy-2-(trifluoromethyl)propenoic acid
TL;DR: 3-Hydroxy-2-(trifluoromethyl)propenoic acid (CAS 2489-89-6) is a chemical compound with molecular formula C4H5F3O3 and molecular weight 158.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3,3-trifluoro-2-(hydroxymethyl)propanoic acid
Also Known As: 3,3,3-trifluoro-2-(hydroxymethyl)propanoic Acid, 2-(Trifluoromethyl)-3-hydroxypropionic acid, 3-Hydroxy-2-trifluoromethylpropionic acid, 3-Hydroxy-2-(trifluoromethyl)propionic acid, a-trifluoromethylhydracrylic acid
| Molecular Formula | C4H5F3O3 |
|---|---|
| Molecular Weight | 158.02 g/mol |
| LogP | 0.2418 |
| Topological Polar Surface Area | 57.53 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 158.01907 |
| Heavy Atoms | 10 |
| Complexity | 130.19974 |
Chemical Identifiers
| CAS Number | 2489-89-6 |
|---|---|
| SMILES | C(C(C(=O)O)C(F)(F)F)O |
Product Overview
3-Hydroxy-2-(trifluoromethyl)propenoic acid (CAS 2489-89-6), with molecular formula C4H5F3O3 and molecular weight 158.02 g/mol. IUPAC: 3,3,3-trifluoro-2-(hydroxymethyl)propanoic acid.
Chemical Property Profile of 3-Hydroxy-2-(trifluoromethyl)propenoic acid
Property Insights of 3-Hydroxy-2-(trifluoromethyl)propenoic acid
The XLogP value of 0.2418 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Hydroxy-2-(trifluoromethyl)propenoic acid. With a topological polar surface area (TPSA) of 57.53 Ų, 3-Hydroxy-2-(trifluoromethyl)propenoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Hydroxy-2-(trifluoromethyl)propenoic acid 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 3-Hydroxy-2-(trifluoromethyl)propenoic acid?
The CAS number of 3-Hydroxy-2-(trifluoromethyl)propenoic acid is 2489-89-6.
What is the molecular formula of 3-Hydroxy-2-(trifluoromethyl)propenoic acid?
The molecular formula of 3-Hydroxy-2-(trifluoromethyl)propenoic acid is C4H5F3O3.
What is the molecular weight of 3-Hydroxy-2-(trifluoromethyl)propenoic acid?
The molecular weight of 3-Hydroxy-2-(trifluoromethyl)propenoic acid is 158.02 g/mol.
Where can I buy 3-Hydroxy-2-(trifluoromethyl)propenoic acid?
You can request a quote for 3-Hydroxy-2-(trifluoromethyl)propenoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Hydroxy-2-(trifluoromethyl)propenoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-Hydroxy-2-(trifluoromethyl)propenoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.