(5-Chloro-2-methoxyanilino)(oxo)acetic acid
TL;DR: (5-Chloro-2-methoxyanilino)(oxo)acetic acid (CAS 444783-62-4) is a chemical compound with molecular formula C9H8ClNO4 and molecular weight 229.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(5-chloro-2-methoxyanilino)-2-oxoacetic acid
Also Known As: (5-chloro-2-methoxyanilino)(oxo)acetic acid, (5-chloro-2-methoxy-phenyl)carbamoylformic Acid, 2-(5-chloro-2-methoxyanilino)-2-oxoacetic acid, [(5-chloro-2-methoxyphenyl)carbamoyl]formic acid, AH-487/41143931
| Molecular Formula | C9H8ClNO4 |
|---|---|
| Molecular Weight | 229.01 g/mol |
| LogP | 1.3717 |
| Topological Polar Surface Area | 75.63 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 229.01419 |
| Heavy Atoms | 15 |
| Complexity | 405.09885 |
Chemical Identifiers
| CAS Number | 444783-62-4 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)Cl)NC(=O)C(=O)O |
Product Overview
(5-Chloro-2-methoxyanilino)(oxo)acetic acid (CAS 444783-62-4), with molecular formula C9H8ClNO4 and molecular weight 229.01 g/mol. IUPAC: 2-(5-chloro-2-methoxyanilino)-2-oxoacetic acid.
Chemical Property Profile of (5-Chloro-2-methoxyanilino)(oxo)acetic acid
Property Insights of (5-Chloro-2-methoxyanilino)(oxo)acetic acid
The XLogP value of 1.3717 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (5-Chloro-2-methoxyanilino)(oxo)acetic acid. The TPSA of 75.63 Ų falls within the moderate polarity range, balancing permeability and solubility for (5-Chloro-2-methoxyanilino)(oxo)acetic acid. Following Lipinski's Rule of Five, (5-Chloro-2-methoxyanilino)(oxo)acetic 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-Chloro-2-methoxyanilino)(oxo)acetic acid?
The CAS number of (5-Chloro-2-methoxyanilino)(oxo)acetic acid is 444783-62-4.
What is the molecular formula of (5-Chloro-2-methoxyanilino)(oxo)acetic acid?
The molecular formula of (5-Chloro-2-methoxyanilino)(oxo)acetic acid is C9H8ClNO4.
What is the molecular weight of (5-Chloro-2-methoxyanilino)(oxo)acetic acid?
The molecular weight of (5-Chloro-2-methoxyanilino)(oxo)acetic acid is 229.01 g/mol.
Where can I buy (5-Chloro-2-methoxyanilino)(oxo)acetic acid?
You can request a quote for (5-Chloro-2-methoxyanilino)(oxo)acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (5-Chloro-2-methoxyanilino)(oxo)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for (5-Chloro-2-methoxyanilino)(oxo)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.