(3R)-4,4,4-trifluoro-3-hydroxy-3-methylbutanoic acid
TL;DR: (3R)-4,4,4-trifluoro-3-hydroxy-3-methylbutanoic acid (CAS 227961-45-7) is a chemical compound with molecular formula C5H7F3O3 and molecular weight 172.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3R)-4,4,4-trifluoro-3-hydroxy-3-methylbutanoic acid
Also Known As: (3R)-4,4,4-trifluoro-3-hydroxy-3-methylbutanoic acid, 4,4,4-Trifluoro-3-hydroxy-3-methylbutyric acid, (3R)-4,4,4-trifluoro-3-hydroxy-3-methylbutanoicacid
| Molecular Formula | C5H7F3O3 |
|---|---|
| Molecular Weight | 172.03 g/mol |
| LogP | 0.7744 |
| Topological Polar Surface Area | 57.53 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 172.03473 |
| Heavy Atoms | 11 |
| Complexity | 160.84581 |
Chemical Identifiers
| CAS Number | 227961-45-7 |
|---|---|
| SMILES | C[C@@](CC(=O)O)(C(F)(F)F)O |
Product Overview
(3R)-4,4,4-trifluoro-3-hydroxy-3-methylbutanoic acid (CAS 227961-45-7), with molecular formula C5H7F3O3 and molecular weight 172.03 g/mol. IUPAC: (3R)-4,4,4-trifluoro-3-hydroxy-3-methylbutanoic acid.
Chemical Property Profile of (3R)-4,4,4-trifluoro-3-hydroxy-3-methylbutanoic acid
Property Insights of (3R)-4,4,4-trifluoro-3-hydroxy-3-methylbutanoic acid
The XLogP value of 0.7744 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3R)-4,4,4-trifluoro-3-hydroxy-3-methylbutanoic acid. With a topological polar surface area (TPSA) of 57.53 Ų, (3R)-4,4,4-trifluoro-3-hydroxy-3-methylbutanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3R)-4,4,4-trifluoro-3-hydroxy-3-methylbutanoic 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 (3R)-4,4,4-trifluoro-3-hydroxy-3-methylbutanoic acid?
The CAS number of (3R)-4,4,4-trifluoro-3-hydroxy-3-methylbutanoic acid is 227961-45-7.
What is the molecular formula of (3R)-4,4,4-trifluoro-3-hydroxy-3-methylbutanoic acid?
The molecular formula of (3R)-4,4,4-trifluoro-3-hydroxy-3-methylbutanoic acid is C5H7F3O3.
What is the molecular weight of (3R)-4,4,4-trifluoro-3-hydroxy-3-methylbutanoic acid?
The molecular weight of (3R)-4,4,4-trifluoro-3-hydroxy-3-methylbutanoic acid is 172.03 g/mol.
Where can I buy (3R)-4,4,4-trifluoro-3-hydroxy-3-methylbutanoic acid?
You can request a quote for (3R)-4,4,4-trifluoro-3-hydroxy-3-methylbutanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3R)-4,4,4-trifluoro-3-hydroxy-3-methylbutanoic acid?
Yes, KEHONG BIO provides custom synthesis services for (3R)-4,4,4-trifluoro-3-hydroxy-3-methylbutanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.