L-Valine, 4,4,4-trifluoro-, (S)-
TL;DR: L-Valine, 4,4,4-trifluoro-, (S)- (CAS 27125-00-4) is a chemical compound with molecular formula C5H8F3NO2 and molecular weight 171.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-amino-4,4,4-trifluoro-3-methylbutanoic acid
Also Known As: 4,4,4-Trifluorovaline, 4,4,4-trifluoro-l-valine, valine, 4,4,4-trifluoro-, 4,4,4-Trifluoro-DL-valine, L-Valine, 4,4,4-trifluoro-, (S)-
| Molecular Formula | C5H8F3NO2 |
|---|---|
| Molecular Weight | 171.05 g/mol |
| LogP | -1.7 |
| Topological Polar Surface Area | 63.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 171.05072 |
| Heavy Atoms | 11 |
| Complexity | 156.0 |
Chemical Identifiers
| CAS Number | 27125-00-4 |
|---|---|
| SMILES | CC([C@@H](C(=O)O)N)C(F)(F)F |
| InChIKey | BAOLXXJPOPIBKA-NFJMKROFSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
L-Valine, 4,4,4-trifluoro-, (S)- (CAS 27125-00-4), with molecular formula C5H8F3NO2 and molecular weight 171.05 g/mol. IUPAC: (2S)-2-amino-4,4,4-trifluoro-3-methylbutanoic acid.
Chemical Property Profile of L-Valine, 4,4,4-trifluoro-, (S)-
Property Insights of L-Valine, 4,4,4-trifluoro-, (S)-
The XLogP value of -1.7 indicates that L-Valine, 4,4,4-trifluoro-, (S)- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 63.3 Ų falls within the moderate polarity range, balancing permeability and solubility for L-Valine, 4,4,4-trifluoro-, (S)-. Following Lipinski's Rule of Five, L-Valine, 4,4,4-trifluoro-, (S)- has 2 hydrogen bond donor(s) and 6 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 L-Valine, 4,4,4-trifluoro-, (S)-?
The CAS number of L-Valine, 4,4,4-trifluoro-, (S)- is 27125-00-4.
What is the molecular formula of L-Valine, 4,4,4-trifluoro-, (S)-?
The molecular formula of L-Valine, 4,4,4-trifluoro-, (S)- is C5H8F3NO2.
What is the molecular weight of L-Valine, 4,4,4-trifluoro-, (S)-?
The molecular weight of L-Valine, 4,4,4-trifluoro-, (S)- is 171.05 g/mol.
Where can I buy L-Valine, 4,4,4-trifluoro-, (S)-?
You can request a quote for L-Valine, 4,4,4-trifluoro-, (S)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for L-Valine, 4,4,4-trifluoro-, (S)-?
Yes, KEHONG BIO provides custom synthesis services for L-Valine, 4,4,4-trifluoro-, (S)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.