![3-[4-(Methoxycarbonyl)anilino]propanoic acid structure](/static/products/3605/36053-86-8.webp)
3-[4-(Methoxycarbonyl)anilino]propanoic acid
TL;DR: 3-[4-(Methoxycarbonyl)anilino]propanoic acid (CAS 36053-86-8) is a chemical compound with molecular formula C11H13NO4 and molecular weight 223.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-methoxycarbonylanilino)propanoic acid
Also Known As: 3-[4-(methoxycarbonyl)anilino]propanoic acid, 3-[(2,5-dichlorophenyl)amino]propanoic acid, 3-(4-methoxycarbonylanilino)propanoic acid, 3-[(4-methoxycarbonylphenyl)amino]propanoic Acid, AP-434/40711902
| Molecular Formula | C11H13NO4 |
|---|---|
| Molecular Weight | 223.08 g/mol |
| LogP | 1.3598 |
| Topological Polar Surface Area | 75.63 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 223.08446 |
| Heavy Atoms | 16 |
| Complexity | 372.07587 |
Chemical Identifiers
| CAS Number | 36053-86-8 |
|---|---|
| SMILES | COC(=O)C1=CC=C(C=C1)NCCC(=O)O |
Product Overview
3-[4-(Methoxycarbonyl)anilino]propanoic acid (CAS 36053-86-8), with molecular formula C11H13NO4 and molecular weight 223.08 g/mol. IUPAC: 3-(4-methoxycarbonylanilino)propanoic acid.
Chemical Property Profile of 3-[4-(Methoxycarbonyl)anilino]propanoic acid
Property Insights of 3-[4-(Methoxycarbonyl)anilino]propanoic acid
The XLogP value of 1.3598 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[4-(Methoxycarbonyl)anilino]propanoic acid. The TPSA of 75.63 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[4-(Methoxycarbonyl)anilino]propanoic acid. Following Lipinski's Rule of Five, 3-[4-(Methoxycarbonyl)anilino]propanoic acid has 2 hydrogen bond donor(s) and 4 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 3-[4-(Methoxycarbonyl)anilino]propanoic acid?
The CAS number of 3-[4-(Methoxycarbonyl)anilino]propanoic acid is 36053-86-8.
What is the molecular formula of 3-[4-(Methoxycarbonyl)anilino]propanoic acid?
The molecular formula of 3-[4-(Methoxycarbonyl)anilino]propanoic acid is C11H13NO4.
What is the molecular weight of 3-[4-(Methoxycarbonyl)anilino]propanoic acid?
The molecular weight of 3-[4-(Methoxycarbonyl)anilino]propanoic acid is 223.08 g/mol.
Where can I buy 3-[4-(Methoxycarbonyl)anilino]propanoic acid?
You can request a quote for 3-[4-(Methoxycarbonyl)anilino]propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[4-(Methoxycarbonyl)anilino]propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-[4-(Methoxycarbonyl)anilino]propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.