4-(N-methylacetamido)benzoic acid
TL;DR: 4-(N-methylacetamido)benzoic acid (CAS 27101-83-3) is a chemical compound with molecular formula C10H11NO3 and molecular weight 193.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[acetyl(methyl)amino]benzoic acid
Also Known As: 4-(N-Methylacetamido)benzoic acid, 4-[acetyl(methyl)amino]benzoic acid, 4-(N-Methylacetamido)benzoicacid, Benzoic acid,4-(acetylmethylamino)-, Benzoic acid, 4-(acetylmethylamino)-
| Molecular Formula | C10H11NO3 |
|---|---|
| Molecular Weight | 193.07 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 57.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 193.0739 |
| Heavy Atoms | 14 |
| Complexity | 232.0 |
Chemical Identifiers
| CAS Number | 27101-83-3 |
|---|---|
| SMILES | CC(=O)N(C)C1=CC=C(C=C1)C(=O)O |
| InChIKey | WPHGIIWEXHFKHI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-(N-methylacetamido)benzoic acid (CAS 27101-83-3), with molecular formula C10H11NO3 and molecular weight 193.07 g/mol. IUPAC: 4-[acetyl(methyl)amino]benzoic acid.
Chemical Property Profile of 4-(N-methylacetamido)benzoic acid
Property Insights of 4-(N-methylacetamido)benzoic acid
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(N-methylacetamido)benzoic acid. With a topological polar surface area (TPSA) of 57.6 Ų, 4-(N-methylacetamido)benzoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(N-methylacetamido)benzoic acid has 1 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-(N-methylacetamido)benzoic acid?
The CAS number of 4-(N-methylacetamido)benzoic acid is 27101-83-3.
What is the molecular formula of 4-(N-methylacetamido)benzoic acid?
The molecular formula of 4-(N-methylacetamido)benzoic acid is C10H11NO3.
What is the molecular weight of 4-(N-methylacetamido)benzoic acid?
The molecular weight of 4-(N-methylacetamido)benzoic acid is 193.07 g/mol.
Where can I buy 4-(N-methylacetamido)benzoic acid?
You can request a quote for 4-(N-methylacetamido)benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(N-methylacetamido)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-(N-methylacetamido)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.