Ethyl 3-acetamido-4-chlorobenzoate
TL;DR: Ethyl 3-acetamido-4-chlorobenzoate (CAS 284665-86-7) is a chemical compound with molecular formula C11H12ClNO3 and molecular weight 241.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-acetamido-4-chlorobenzoate
Also Known As: ethyl 3-acetamido-4-chlorobenzoate, Ethyl 3-(acetylamino)-4-chlorobenzoate, Benzoic acid, 3-(acetylamino)-4-chloro-, ethyl ester
| Molecular Formula | C11H12ClNO3 |
|---|---|
| Molecular Weight | 241.05 g/mol |
| LogP | 2.4751 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 241.05057 |
| Heavy Atoms | 16 |
| Complexity | 417.69073 |
Chemical Identifiers
| CAS Number | 284665-86-7 |
|---|---|
| SMILES | CCOC(=O)C1=CC(=C(C=C1)Cl)NC(=O)C |
Product Overview
Ethyl 3-acetamido-4-chlorobenzoate (CAS 284665-86-7), with molecular formula C11H12ClNO3 and molecular weight 241.05 g/mol. IUPAC: ethyl 3-acetamido-4-chlorobenzoate.
Chemical Property Profile of Ethyl 3-acetamido-4-chlorobenzoate
Property Insights of Ethyl 3-acetamido-4-chlorobenzoate
The XLogP value of 2.4751 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 3-acetamido-4-chlorobenzoate. With a topological polar surface area (TPSA) of 55.4 Ų, Ethyl 3-acetamido-4-chlorobenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 3-acetamido-4-chlorobenzoate 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 Ethyl 3-acetamido-4-chlorobenzoate?
The CAS number of Ethyl 3-acetamido-4-chlorobenzoate is 284665-86-7.
What is the molecular formula of Ethyl 3-acetamido-4-chlorobenzoate?
The molecular formula of Ethyl 3-acetamido-4-chlorobenzoate is C11H12ClNO3.
What is the molecular weight of Ethyl 3-acetamido-4-chlorobenzoate?
The molecular weight of Ethyl 3-acetamido-4-chlorobenzoate is 241.05 g/mol.
Where can I buy Ethyl 3-acetamido-4-chlorobenzoate?
You can request a quote for Ethyl 3-acetamido-4-chlorobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 3-acetamido-4-chlorobenzoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 3-acetamido-4-chlorobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.