4-Acetamidobenzene-1,3-dicarboxylic acid
TL;DR: 4-Acetamidobenzene-1,3-dicarboxylic acid (CAS 7501-68-0) is a chemical compound with molecular formula C10H9NO5 and molecular weight 223.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-acetamidobenzene-1,3-dicarboxylic acid
Also Known As: 4-Acetamidoisophthalic acid, 4-acetamidobenzene-1,3-dicarboxylic acid, 4-(acetylamino)isophthalic acid, 4-(acetylamino)benzene-1,3-dicarboxylic acid
| Molecular Formula | C10H9NO5 |
|---|---|
| Molecular Weight | 223.05 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 104.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 223.04807 |
| Heavy Atoms | 16 |
| Complexity | 314.0 |
Chemical Identifiers
| CAS Number | 7501-68-0 |
|---|---|
| SMILES | CC(=O)NC1=C(C=C(C=C1)C(=O)O)C(=O)O |
| InChIKey | KFABBSXAHCCRSK-UHFFFAOYSA-N |
Product Overview
4-Acetamidobenzene-1,3-dicarboxylic acid (CAS 7501-68-0), with molecular formula C10H9NO5 and molecular weight 223.05 g/mol. IUPAC: 4-acetamidobenzene-1,3-dicarboxylic acid.
Chemical Property Profile of 4-Acetamidobenzene-1,3-dicarboxylic acid
Property Insights of 4-Acetamidobenzene-1,3-dicarboxylic acid
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Acetamidobenzene-1,3-dicarboxylic acid. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Acetamidobenzene-1,3-dicarboxylic acid. Following Lipinski's Rule of Five, 4-Acetamidobenzene-1,3-dicarboxylic acid has 3 hydrogen bond donor(s) and 5 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-Acetamidobenzene-1,3-dicarboxylic acid?
The CAS number of 4-Acetamidobenzene-1,3-dicarboxylic acid is 7501-68-0.
What is the molecular formula of 4-Acetamidobenzene-1,3-dicarboxylic acid?
The molecular formula of 4-Acetamidobenzene-1,3-dicarboxylic acid is C10H9NO5.
What is the molecular weight of 4-Acetamidobenzene-1,3-dicarboxylic acid?
The molecular weight of 4-Acetamidobenzene-1,3-dicarboxylic acid is 223.05 g/mol.
Where can I buy 4-Acetamidobenzene-1,3-dicarboxylic acid?
You can request a quote for 4-Acetamidobenzene-1,3-dicarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Acetamidobenzene-1,3-dicarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-Acetamidobenzene-1,3-dicarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.