(R)-2-((2-Chloro-4-(trifluoromethyl)phenyl)amino)-3-methylbutanoic acid
TL;DR: (R)-2-((2-Chloro-4-(trifluoromethyl)phenyl)amino)-3-methylbutanoic acid (CAS 76769-07-8) is a chemical compound with molecular formula C12H13ClF3NO2 and molecular weight 295.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R)-2-[2-chloro-4-(trifluoromethyl)anilino]-3-methylbutanoic acid
Also Known As: tau-fluvalinate TP1, (R)-2-((2-Chloro-4-(trifluoromethyl)phenyl)amino)-3-methylbutanoic acid, N-[2-Chloro-4-(trifluoromethyl)phenyl]-D-valine, (2-chloro-4-(trifluoromethyl)phenyl)-D-valine, N-2-Chloro-4-(trifluoromethyl)phenyl-D-valine
| Molecular Formula | C12H13ClF3NO2 |
|---|---|
| Molecular Weight | 295.06 g/mol |
| LogP | 3.8799 |
| Topological Polar Surface Area | 49.33 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 295.0587 |
| Heavy Atoms | 19 |
| Complexity | 474.53256 |
Chemical Identifiers
| CAS Number | 76769-07-8 |
|---|---|
| SMILES | CC(C)[C@H](C(=O)O)NC1=C(C=C(C=C1)C(F)(F)F)Cl |
Product Overview
(R)-2-((2-Chloro-4-(trifluoromethyl)phenyl)amino)-3-methylbutanoic acid (CAS 76769-07-8), with molecular formula C12H13ClF3NO2 and molecular weight 295.06 g/mol. IUPAC: (2R)-2-[2-chloro-4-(trifluoromethyl)anilino]-3-methylbutanoic acid.
Chemical Property Profile of (R)-2-((2-Chloro-4-(trifluoromethyl)phenyl)amino)-3-methylbutanoic acid
Property Insights of (R)-2-((2-Chloro-4-(trifluoromethyl)phenyl)amino)-3-methylbutanoic acid
The XLogP value of 3.8799 indicates that (R)-2-((2-Chloro-4-(trifluoromethyl)phenyl)amino)-3-methylbutanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.33 Ų, (R)-2-((2-Chloro-4-(trifluoromethyl)phenyl)amino)-3-methylbutanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (R)-2-((2-Chloro-4-(trifluoromethyl)phenyl)amino)-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 (R)-2-((2-Chloro-4-(trifluoromethyl)phenyl)amino)-3-methylbutanoic acid?
The CAS number of (R)-2-((2-Chloro-4-(trifluoromethyl)phenyl)amino)-3-methylbutanoic acid is 76769-07-8.
What is the molecular formula of (R)-2-((2-Chloro-4-(trifluoromethyl)phenyl)amino)-3-methylbutanoic acid?
The molecular formula of (R)-2-((2-Chloro-4-(trifluoromethyl)phenyl)amino)-3-methylbutanoic acid is C12H13ClF3NO2.
What is the molecular weight of (R)-2-((2-Chloro-4-(trifluoromethyl)phenyl)amino)-3-methylbutanoic acid?
The molecular weight of (R)-2-((2-Chloro-4-(trifluoromethyl)phenyl)amino)-3-methylbutanoic acid is 295.06 g/mol.
Where can I buy (R)-2-((2-Chloro-4-(trifluoromethyl)phenyl)amino)-3-methylbutanoic acid?
You can request a quote for (R)-2-((2-Chloro-4-(trifluoromethyl)phenyl)amino)-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 (R)-2-((2-Chloro-4-(trifluoromethyl)phenyl)amino)-3-methylbutanoic acid?
Yes, KEHONG BIO provides custom synthesis services for (R)-2-((2-Chloro-4-(trifluoromethyl)phenyl)amino)-3-methylbutanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.