2-((2-Methyl-1-oxo-2-propen-1-yl)amino)benzoic acid
TL;DR: 2-((2-Methyl-1-oxo-2-propen-1-yl)amino)benzoic acid (CAS 7600-39-7) is a chemical compound with molecular formula C11H11NO3 and molecular weight 205.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-methylprop-2-enoylamino)benzoic acid
Also Known As: 2-(Methacryloylamino)benzoic acid, methacrylic acid o-carboxyphenylamide, 2-(2-methylprop-2-enoylamino)benzoic Acid, 2-[(2-Methylprop-2-enoyl)amino]benzoic acid, 2-(2-METHYLPROP-2-ENAMIDO)BENZOIC ACID
| Molecular Formula | C11H11NO3 |
|---|---|
| Molecular Weight | 205.07 g/mol |
| LogP | 1.8994 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 205.0739 |
| Heavy Atoms | 15 |
| Complexity | 423.59613 |
Chemical Identifiers
| CAS Number | 7600-39-7 |
|---|---|
| SMILES | CC(=C)C(=O)NC1=CC=CC=C1C(=O)O |
Product Overview
2-((2-Methyl-1-oxo-2-propen-1-yl)amino)benzoic acid (CAS 7600-39-7), with molecular formula C11H11NO3 and molecular weight 205.07 g/mol. IUPAC: 2-(2-methylprop-2-enoylamino)benzoic acid.
Chemical Property Profile of 2-((2-Methyl-1-oxo-2-propen-1-yl)amino)benzoic acid
Property Insights of 2-((2-Methyl-1-oxo-2-propen-1-yl)amino)benzoic acid
The XLogP value of 1.8994 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-((2-Methyl-1-oxo-2-propen-1-yl)amino)benzoic acid. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-((2-Methyl-1-oxo-2-propen-1-yl)amino)benzoic acid. Following Lipinski's Rule of Five, 2-((2-Methyl-1-oxo-2-propen-1-yl)amino)benzoic acid has 2 hydrogen bond donor(s) and 2 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 2-((2-Methyl-1-oxo-2-propen-1-yl)amino)benzoic acid?
The CAS number of 2-((2-Methyl-1-oxo-2-propen-1-yl)amino)benzoic acid is 7600-39-7.
What is the molecular formula of 2-((2-Methyl-1-oxo-2-propen-1-yl)amino)benzoic acid?
The molecular formula of 2-((2-Methyl-1-oxo-2-propen-1-yl)amino)benzoic acid is C11H11NO3.
What is the molecular weight of 2-((2-Methyl-1-oxo-2-propen-1-yl)amino)benzoic acid?
The molecular weight of 2-((2-Methyl-1-oxo-2-propen-1-yl)amino)benzoic acid is 205.07 g/mol.
Where can I buy 2-((2-Methyl-1-oxo-2-propen-1-yl)amino)benzoic acid?
You can request a quote for 2-((2-Methyl-1-oxo-2-propen-1-yl)amino)benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((2-Methyl-1-oxo-2-propen-1-yl)amino)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-((2-Methyl-1-oxo-2-propen-1-yl)amino)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.