Acetic acid, (p-aminobenzoyl)-, ethyl ester (6CI,7CI)
TL;DR: Acetic acid, (p-aminobenzoyl)-, ethyl ester (6CI,7CI) (CAS 103502-01-8) 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.
ethyl 3-(4-aminophenyl)-3-oxopropanoate
Also Known As: ethyl 3-(4-aminophenyl)-3-oxopropanoate, Ethyl (p-aminobenzoyl)acetate, ethyl p-aminobenzoylacetate, Ethyl 4-amino-beta-oxobenzenepropanoate, Benzenepropanoic acid, 4-amino-beta-oxo-, ethyl ester
| Molecular Formula | C11H13NO3 |
|---|---|
| Molecular Weight | 207.09 g/mol |
| LogP | 1.4047 |
| Topological Polar Surface Area | 69.39 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 207.08954 |
| Heavy Atoms | 15 |
| Complexity | 356.6007 |
Chemical Identifiers
| CAS Number | 103502-01-8 |
|---|---|
| SMILES | CCOC(=O)CC(=O)C1=CC=C(C=C1)N |
Product Overview
Acetic acid, (p-aminobenzoyl)-, ethyl ester (6CI,7CI) (CAS 103502-01-8), with molecular formula C11H13NO3 and molecular weight 207.09 g/mol. IUPAC: ethyl 3-(4-aminophenyl)-3-oxopropanoate.
Chemical Property Profile of Acetic acid, (p-aminobenzoyl)-, ethyl ester (6CI,7CI)
Property Insights of Acetic acid, (p-aminobenzoyl)-, ethyl ester (6CI,7CI)
The XLogP value of 1.4047 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetic acid, (p-aminobenzoyl)-, ethyl ester (6CI,7CI). The TPSA of 69.39 Ų falls within the moderate polarity range, balancing permeability and solubility for Acetic acid, (p-aminobenzoyl)-, ethyl ester (6CI,7CI). Following Lipinski's Rule of Five, Acetic acid, (p-aminobenzoyl)-, ethyl ester (6CI,7CI) has 1 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 Acetic acid, (p-aminobenzoyl)-, ethyl ester (6CI,7CI)?
The CAS number of Acetic acid, (p-aminobenzoyl)-, ethyl ester (6CI,7CI) is 103502-01-8.
What is the molecular formula of Acetic acid, (p-aminobenzoyl)-, ethyl ester (6CI,7CI)?
The molecular formula of Acetic acid, (p-aminobenzoyl)-, ethyl ester (6CI,7CI) is C11H13NO3.
What is the molecular weight of Acetic acid, (p-aminobenzoyl)-, ethyl ester (6CI,7CI)?
The molecular weight of Acetic acid, (p-aminobenzoyl)-, ethyl ester (6CI,7CI) is 207.09 g/mol.
Where can I buy Acetic acid, (p-aminobenzoyl)-, ethyl ester (6CI,7CI)?
You can request a quote for Acetic acid, (p-aminobenzoyl)-, ethyl ester (6CI,7CI) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetic acid, (p-aminobenzoyl)-, ethyl ester (6CI,7CI)?
Yes, KEHONG BIO provides custom synthesis services for Acetic acid, (p-aminobenzoyl)-, ethyl ester (6CI,7CI) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.