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Ethyl [(4-bromophenyl)amino]acetate
TL;DR: Ethyl [(4-bromophenyl)amino]acetate (CAS 2521-92-8) is a chemical compound with molecular formula C10H12BrNO2 and molecular weight 257.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(4-bromoanilino)acetate
Also Known As: ethyl [(4-bromophenyl)amino]acetate, ethyl N-(4-bromophenyl)glycinate, ethyl 2-(4-bromoanilino)acetate, ETHYL 2-[(4-BROMOPHENYL)AMINO]ACETATE, Ethyl 2-((4-bromophenyl)amino)acetate
| Molecular Formula | C10H12BrNO2 |
|---|---|
| Molecular Weight | 257.01 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 257.00513 |
| Heavy Atoms | 14 |
| Complexity | 179.0 |
Chemical Identifiers
| CAS Number | 2521-92-8 |
|---|---|
| SMILES | CCOC(=O)CNC1=CC=C(C=C1)Br |
| InChIKey | SDVWUMUCGZEZNB-UHFFFAOYSA-N |
Product Overview
Ethyl [(4-bromophenyl)amino]acetate (CAS 2521-92-8), with molecular formula C10H12BrNO2 and molecular weight 257.01 g/mol. IUPAC: ethyl 2-(4-bromoanilino)acetate.
Chemical Property Profile of Ethyl [(4-bromophenyl)amino]acetate
Property Insights of Ethyl [(4-bromophenyl)amino]acetate
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl [(4-bromophenyl)amino]acetate. With a topological polar surface area (TPSA) of 38.3 Ų, Ethyl [(4-bromophenyl)amino]acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl [(4-bromophenyl)amino]acetate 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 [(4-bromophenyl)amino]acetate?
The CAS number of Ethyl [(4-bromophenyl)amino]acetate is 2521-92-8.
What is the molecular formula of Ethyl [(4-bromophenyl)amino]acetate?
The molecular formula of Ethyl [(4-bromophenyl)amino]acetate is C10H12BrNO2.
What is the molecular weight of Ethyl [(4-bromophenyl)amino]acetate?
The molecular weight of Ethyl [(4-bromophenyl)amino]acetate is 257.01 g/mol.
Where can I buy Ethyl [(4-bromophenyl)amino]acetate?
You can request a quote for Ethyl [(4-bromophenyl)amino]acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl [(4-bromophenyl)amino]acetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl [(4-bromophenyl)amino]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.