methyl (2S)-3,3,3-trifluoro-2-hydroxypropanoate
TL;DR: methyl (2S)-3,3,3-trifluoro-2-hydroxypropanoate (CAS 189060-64-8) 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.
methyl (2S)-3,3,3-trifluoro-2-hydroxypropanoate
Also Known As: methyl (2S)-3,3,3-trifluoro-2-hydroxypropanoate, methyl(2S)-3,3,3-trifluoro-2-hydroxypropanoate, (S)-Methyl 3,3,3-trifluoro-2-hydroxypropanoate, Methyl (S)-3,3,3-Trifluoro-2-hydroxypropanoate, 867-566-6
| Molecular Formula | C4H5F3O3 |
|---|---|
| Molecular Weight | 158.02 g/mol |
| LogP | 0.0826 |
| Topological Polar Surface Area | 46.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 158.01907 |
| Heavy Atoms | 10 |
| Complexity | 130.19974 |
Chemical Identifiers
| CAS Number | 189060-64-8 |
|---|---|
| SMILES | COC(=O)[C@@H](C(F)(F)F)O |
Product Overview
methyl (2S)-3,3,3-trifluoro-2-hydroxypropanoate (CAS 189060-64-8), with molecular formula C4H5F3O3 and molecular weight 158.02 g/mol. IUPAC: methyl (2S)-3,3,3-trifluoro-2-hydroxypropanoate.
Chemical Property Profile of methyl (2S)-3,3,3-trifluoro-2-hydroxypropanoate
Property Insights of methyl (2S)-3,3,3-trifluoro-2-hydroxypropanoate
The XLogP value of 0.0826 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl (2S)-3,3,3-trifluoro-2-hydroxypropanoate. With a topological polar surface area (TPSA) of 46.53 Ų, methyl (2S)-3,3,3-trifluoro-2-hydroxypropanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, methyl (2S)-3,3,3-trifluoro-2-hydroxypropanoate has 1 hydrogen bond donor(s) and 3 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 methyl (2S)-3,3,3-trifluoro-2-hydroxypropanoate?
The CAS number of methyl (2S)-3,3,3-trifluoro-2-hydroxypropanoate is 189060-64-8.
What is the molecular formula of methyl (2S)-3,3,3-trifluoro-2-hydroxypropanoate?
The molecular formula of methyl (2S)-3,3,3-trifluoro-2-hydroxypropanoate is C4H5F3O3.
What is the molecular weight of methyl (2S)-3,3,3-trifluoro-2-hydroxypropanoate?
The molecular weight of methyl (2S)-3,3,3-trifluoro-2-hydroxypropanoate is 158.02 g/mol.
Where can I buy methyl (2S)-3,3,3-trifluoro-2-hydroxypropanoate?
You can request a quote for methyl (2S)-3,3,3-trifluoro-2-hydroxypropanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl (2S)-3,3,3-trifluoro-2-hydroxypropanoate?
Yes, KEHONG BIO provides custom synthesis services for methyl (2S)-3,3,3-trifluoro-2-hydroxypropanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.