6-Amino-2-chloro-3-fluorobenzoic acid
TL;DR: 6-Amino-2-chloro-3-fluorobenzoic acid (CAS 681459-97-2) is a chemical compound with molecular formula C7H5ClFNO2 and molecular weight 189.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-amino-2-chloro-3-fluorobenzoic acid
Also Known As: 6-amino-2-chloro-3-fluorobenzoic acid, 6-Amino-2-chloro-3-fluorobenzoicAcid, 6-amino-2-chloro-3-fluoro-benzoic Acid, L-1172
| Molecular Formula | C7H5ClFNO2 |
|---|---|
| Molecular Weight | 189.00 g/mol |
| LogP | 1.7595 |
| Topological Polar Surface Area | 63.32 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 188.99928 |
| Heavy Atoms | 12 |
| Complexity | 340.4234 |
Chemical Identifiers
| CAS Number | 681459-97-2 |
|---|---|
| SMILES | C1=CC(=C(C(=C1N)C(=O)O)Cl)F |
Product Overview
6-Amino-2-chloro-3-fluorobenzoic acid (CAS 681459-97-2), with molecular formula C7H5ClFNO2 and molecular weight 189.00 g/mol. IUPAC: 6-amino-2-chloro-3-fluorobenzoic acid.
Chemical Property Profile of 6-Amino-2-chloro-3-fluorobenzoic acid
Property Insights of 6-Amino-2-chloro-3-fluorobenzoic acid
The XLogP value of 1.7595 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Amino-2-chloro-3-fluorobenzoic acid. The TPSA of 63.32 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Amino-2-chloro-3-fluorobenzoic acid. Following Lipinski's Rule of Five, 6-Amino-2-chloro-3-fluorobenzoic 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 6-Amino-2-chloro-3-fluorobenzoic acid?
The CAS number of 6-Amino-2-chloro-3-fluorobenzoic acid is 681459-97-2.
What is the molecular formula of 6-Amino-2-chloro-3-fluorobenzoic acid?
The molecular formula of 6-Amino-2-chloro-3-fluorobenzoic acid is C7H5ClFNO2.
What is the molecular weight of 6-Amino-2-chloro-3-fluorobenzoic acid?
The molecular weight of 6-Amino-2-chloro-3-fluorobenzoic acid is 189.00 g/mol.
Where can I buy 6-Amino-2-chloro-3-fluorobenzoic acid?
You can request a quote for 6-Amino-2-chloro-3-fluorobenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Amino-2-chloro-3-fluorobenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 6-Amino-2-chloro-3-fluorobenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.