4-Chloro-2-acetamidobenzoic acid
TL;DR: 4-Chloro-2-acetamidobenzoic acid (CAS 65876-30-4) is a chemical compound with molecular formula C9H8ClNO3 and molecular weight 213.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-acetamido-4-chlorobenzoic acid
Also Known As: 2-acetamido-4-chlorobenzoic acid, 2-(acetylamino)-4-chlorobenzoic acid, 4-chloro-2-acetamidobenzoic acid, Maybridge1_000389, 2-Acetamido-4-chlorobenzoicacid
| Molecular Formula | C9H8ClNO3 |
|---|---|
| Molecular Weight | 213.02 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 213.01927 |
| Heavy Atoms | 14 |
| Complexity | 244.0 |
Chemical Identifiers
| CAS Number | 65876-30-4 |
|---|---|
| SMILES | CC(=O)NC1=C(C=CC(=C1)Cl)C(=O)O |
| InChIKey | SONOHJNKSOBNKY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Chloro-2-acetamidobenzoic acid (CAS 65876-30-4), with molecular formula C9H8ClNO3 and molecular weight 213.02 g/mol. IUPAC: 2-acetamido-4-chlorobenzoic acid.
Chemical Property Profile of 4-Chloro-2-acetamidobenzoic acid
Property Insights of 4-Chloro-2-acetamidobenzoic acid
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Chloro-2-acetamidobenzoic acid. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Chloro-2-acetamidobenzoic acid. Following Lipinski's Rule of Five, 4-Chloro-2-acetamidobenzoic 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 4-Chloro-2-acetamidobenzoic acid?
The CAS number of 4-Chloro-2-acetamidobenzoic acid is 65876-30-4.
What is the molecular formula of 4-Chloro-2-acetamidobenzoic acid?
The molecular formula of 4-Chloro-2-acetamidobenzoic acid is C9H8ClNO3.
What is the molecular weight of 4-Chloro-2-acetamidobenzoic acid?
The molecular weight of 4-Chloro-2-acetamidobenzoic acid is 213.02 g/mol.
Where can I buy 4-Chloro-2-acetamidobenzoic acid?
You can request a quote for 4-Chloro-2-acetamidobenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Chloro-2-acetamidobenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-Chloro-2-acetamidobenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.