5-Amino-2-chlorobenzoic acid
TL;DR: 5-Amino-2-chlorobenzoic acid (CAS 89-54-3) is a chemical compound with molecular formula C7H6ClNO2 and molecular weight 171.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-amino-2-chlorobenzoic acid
Also Known As: 5-Amino-2-chlorobenzoic acid, null, 2-Chloro-5-aminobenzoic acid, Benzoic acid, 5-amino-2-chloro-, 3-amino-6-chlorobenzoic acid
| Molecular Formula | C7H6ClNO2 |
|---|---|
| Molecular Weight | 171.01 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 63.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 171.00871 |
| Heavy Atoms | 11 |
| Complexity | 163.0 |
Chemical Identifiers
| CAS Number | 89-54-3 |
|---|---|
| SMILES | C1=CC(=C(C=C1N)C(=O)O)Cl |
| InChIKey | GVCFFVPEOLCYNN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-Amino-2-chlorobenzoic acid (CAS 89-54-3), with molecular formula C7H6ClNO2 and molecular weight 171.01 g/mol. IUPAC: 5-amino-2-chlorobenzoic acid.
Chemical Property Profile of 5-Amino-2-chlorobenzoic acid
Property Insights of 5-Amino-2-chlorobenzoic acid
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Amino-2-chlorobenzoic acid. The TPSA of 63.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Amino-2-chlorobenzoic acid. Following Lipinski's Rule of Five, 5-Amino-2-chlorobenzoic acid has 2 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 5-Amino-2-chlorobenzoic acid?
The CAS number of 5-Amino-2-chlorobenzoic acid is 89-54-3.
What is the molecular formula of 5-Amino-2-chlorobenzoic acid?
The molecular formula of 5-Amino-2-chlorobenzoic acid is C7H6ClNO2.
What is the molecular weight of 5-Amino-2-chlorobenzoic acid?
The molecular weight of 5-Amino-2-chlorobenzoic acid is 171.01 g/mol.
Where can I buy 5-Amino-2-chlorobenzoic acid?
You can request a quote for 5-Amino-2-chlorobenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Amino-2-chlorobenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-Amino-2-chlorobenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.