4-methyl-3-(propanoylamino)benzoic Acid
TL;DR: 4-methyl-3-(propanoylamino)benzoic Acid (CAS 516470-29-4) is a chemical compound with molecular formula C11H13NO3 and molecular weight 207.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-3-(propanoylamino)benzoic acid
Also Known As: 4-methyl-3-(propanoylamino)benzoic Acid, 4-METHYL-3-(PROPIONYLAMINO)BENZOIC ACID, Benzoic acid, 4-methyl-3-[(1-oxopropyl)amino]- (9CI), benzoic acid,4-methyl-3-[(1-oxopropyl)amino]-, BENZOIC ACID, 4-METHYL-3-[(1-OXOPROPYL)AMINO]-
| Molecular Formula | C11H13NO3 |
|---|---|
| Molecular Weight | 207.09 g/mol |
| LogP | 2.04172 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 207.08954 |
| Heavy Atoms | 15 |
| Complexity | 398.81955 |
Chemical Identifiers
| CAS Number | 516470-29-4 |
|---|---|
| SMILES | CCC(=O)NC1=C(C=CC(=C1)C(=O)O)C |
Product Overview
4-methyl-3-(propanoylamino)benzoic Acid (CAS 516470-29-4), with molecular formula C11H13NO3 and molecular weight 207.09 g/mol. IUPAC: 4-methyl-3-(propanoylamino)benzoic acid.
Chemical Property Profile of 4-methyl-3-(propanoylamino)benzoic Acid
Property Insights of 4-methyl-3-(propanoylamino)benzoic Acid
The XLogP value of 2.04172 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-methyl-3-(propanoylamino)benzoic Acid. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-methyl-3-(propanoylamino)benzoic Acid. Following Lipinski's Rule of Five, 4-methyl-3-(propanoylamino)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 4-methyl-3-(propanoylamino)benzoic Acid?
The CAS number of 4-methyl-3-(propanoylamino)benzoic Acid is 516470-29-4.
What is the molecular formula of 4-methyl-3-(propanoylamino)benzoic Acid?
The molecular formula of 4-methyl-3-(propanoylamino)benzoic Acid is C11H13NO3.
What is the molecular weight of 4-methyl-3-(propanoylamino)benzoic Acid?
The molecular weight of 4-methyl-3-(propanoylamino)benzoic Acid is 207.09 g/mol.
Where can I buy 4-methyl-3-(propanoylamino)benzoic Acid?
You can request a quote for 4-methyl-3-(propanoylamino)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-methyl-3-(propanoylamino)benzoic Acid?
Yes, KEHONG BIO provides custom synthesis services for 4-methyl-3-(propanoylamino)benzoic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.