Ethyl (2-bromopropionamido)acetate
TL;DR: Ethyl (2-bromopropionamido)acetate (CAS 25413-02-9) is a chemical compound with molecular formula C7H12BrNO3 and molecular weight 237.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(2-bromopropanoylamino)acetate
Also Known As: Ethyl (2-bromopropionamido)acetate, ethyl 2-(2-bromopropanoylamino)acetate, Acetic acid, (2-bromopropionamido)-, ethyl ester, Glycine, N-(2-bromo-1-oxopropyl)-, ethyl ester, N-(2-Bromo-1-oxopropyl)glycine, ethyl ester
| Molecular Formula | C7H12BrNO3 |
|---|---|
| Molecular Weight | 237.00 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 237.00006 |
| Heavy Atoms | 12 |
| Complexity | 172.0 |
Chemical Identifiers
| CAS Number | 25413-02-9 |
|---|---|
| SMILES | CCOC(=O)CNC(=O)C(C)Br |
| InChIKey | KGHDYULSVOTUPI-UHFFFAOYSA-N |
Product Overview
Ethyl (2-bromopropionamido)acetate (CAS 25413-02-9), with molecular formula C7H12BrNO3 and molecular weight 237.00 g/mol. IUPAC: ethyl 2-(2-bromopropanoylamino)acetate.
Chemical Property Profile of Ethyl (2-bromopropionamido)acetate
Property Insights of Ethyl (2-bromopropionamido)acetate
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl (2-bromopropionamido)acetate. With a topological polar surface area (TPSA) of 55.4 Ų, Ethyl (2-bromopropionamido)acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl (2-bromopropionamido)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 (2-bromopropionamido)acetate?
The CAS number of Ethyl (2-bromopropionamido)acetate is 25413-02-9.
What is the molecular formula of Ethyl (2-bromopropionamido)acetate?
The molecular formula of Ethyl (2-bromopropionamido)acetate is C7H12BrNO3.
What is the molecular weight of Ethyl (2-bromopropionamido)acetate?
The molecular weight of Ethyl (2-bromopropionamido)acetate is 237.00 g/mol.
Where can I buy Ethyl (2-bromopropionamido)acetate?
You can request a quote for Ethyl (2-bromopropionamido)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl (2-bromopropionamido)acetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl (2-bromopropionamido)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.