![3-chloro-4-[[(2R)-3,3,3-trifluoro-2-hydroxy-2-methylpropanoyl]amino]benzoic acid structure](/static/products/243/243982-49-2.png)
3-chloro-4-[[(2R)-3,3,3-trifluoro-2-hydroxy-2-methylpropanoyl]amino]benzoic acid
TL;DR: 3-chloro-4-[[(2R)-3,3,3-trifluoro-2-hydroxy-2-methylpropanoyl]amino]benzoic acid (CAS 243982-49-2) is a chemical compound with molecular formula C11H9ClF3NO4 and molecular weight 311.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-4-[[(2R)-3,3,3-trifluoro-2-hydroxy-2-methylpropanoyl]amino]benzoic acid
Also Known As: J1.158.275C, (R)-3-Chloro-4-(3,3,3-trifluoro-2-hydroxy-2-methylpropanamido)benzoic acid, 3-chloro-4-[(2R)-3,3,3-trifluoro-2-hydroxy-2-methylpropanamido]benzoic acid, 3-chloro-4-[[(2R)-3,3,3-trifluoro-2-hydroxy-2-methyl-propanoyl]amino]benzoic Acid, 4-[[(R)-2-Hydroxy-2-methyl-3,3,3-trifluoropropionyl]amino]-3-chlorobenzoic acid
| Molecular Formula | C11H9ClF3NO4 |
|---|---|
| Molecular Weight | 311.02 g/mol |
| LogP | 2.29 |
| Topological Polar Surface Area | 86.63 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 311.0172 |
| Heavy Atoms | 20 |
| Complexity | 557.0895 |
Chemical Identifiers
| CAS Number | 243982-49-2 |
|---|---|
| SMILES | C[C@@](C(=O)NC1=C(C=C(C=C1)C(=O)O)Cl)(C(F)(F)F)O |
Product Overview
3-chloro-4-[[(2R)-3,3,3-trifluoro-2-hydroxy-2-methylpropanoyl]amino]benzoic acid (CAS 243982-49-2), with molecular formula C11H9ClF3NO4 and molecular weight 311.02 g/mol. IUPAC: 3-chloro-4-[[(2R)-3,3,3-trifluoro-2-hydroxy-2-methylpropanoyl]amino]benzoic acid.
Chemical Property Profile of 3-chloro-4-[[(2R)-3,3,3-trifluoro-2-hydroxy-2-methylpropanoyl]amino]benzoic acid
Property Insights of 3-chloro-4-[[(2R)-3,3,3-trifluoro-2-hydroxy-2-methylpropanoyl]amino]benzoic acid
The XLogP value of 2.29 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-chloro-4-[[(2R)-3,3,3-trifluoro-2-hydroxy-2-methylpropanoyl]amino]benzoic acid. The TPSA of 86.63 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-chloro-4-[[(2R)-3,3,3-trifluoro-2-hydroxy-2-methylpropanoyl]amino]benzoic acid. Following Lipinski's Rule of Five, 3-chloro-4-[[(2R)-3,3,3-trifluoro-2-hydroxy-2-methylpropanoyl]amino]benzoic acid has 3 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 3-chloro-4-[[(2R)-3,3,3-trifluoro-2-hydroxy-2-methylpropanoyl]amino]benzoic acid?
The CAS number of 3-chloro-4-[[(2R)-3,3,3-trifluoro-2-hydroxy-2-methylpropanoyl]amino]benzoic acid is 243982-49-2.
What is the molecular formula of 3-chloro-4-[[(2R)-3,3,3-trifluoro-2-hydroxy-2-methylpropanoyl]amino]benzoic acid?
The molecular formula of 3-chloro-4-[[(2R)-3,3,3-trifluoro-2-hydroxy-2-methylpropanoyl]amino]benzoic acid is C11H9ClF3NO4.
What is the molecular weight of 3-chloro-4-[[(2R)-3,3,3-trifluoro-2-hydroxy-2-methylpropanoyl]amino]benzoic acid?
The molecular weight of 3-chloro-4-[[(2R)-3,3,3-trifluoro-2-hydroxy-2-methylpropanoyl]amino]benzoic acid is 311.02 g/mol.
Where can I buy 3-chloro-4-[[(2R)-3,3,3-trifluoro-2-hydroxy-2-methylpropanoyl]amino]benzoic acid?
You can request a quote for 3-chloro-4-[[(2R)-3,3,3-trifluoro-2-hydroxy-2-methylpropanoyl]amino]benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-chloro-4-[[(2R)-3,3,3-trifluoro-2-hydroxy-2-methylpropanoyl]amino]benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-chloro-4-[[(2R)-3,3,3-trifluoro-2-hydroxy-2-methylpropanoyl]amino]benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.