Ethyl 4-(2-chloroacetamido)butanoate
TL;DR: Ethyl 4-(2-chloroacetamido)butanoate (CAS 318271-37-3) is a chemical compound with molecular formula C8H14ClNO3 and molecular weight 207.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[(2-chloroacetyl)amino]butanoate
Also Known As: ethyl 4-(2-chloroacetamido)butanoate, 4-(2-Chloro-acetylamino)-butyric acid ethyl ester, ethyl 4-[(2-chloroacetyl)amino]butanoate, ethyl4-(2-chloroacetamido)butanoate
| Molecular Formula | C8H14ClNO3 |
|---|---|
| Molecular Weight | 207.07 g/mol |
| LogP | 0.6847 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 207.06622 |
| Heavy Atoms | 13 |
| Complexity | 172.77208 |
Chemical Identifiers
| CAS Number | 318271-37-3 |
|---|---|
| SMILES | CCOC(=O)CCCNC(=O)CCl |
Product Overview
Ethyl 4-(2-chloroacetamido)butanoate (CAS 318271-37-3), with molecular formula C8H14ClNO3 and molecular weight 207.07 g/mol. IUPAC: ethyl 4-[(2-chloroacetyl)amino]butanoate.
Chemical Property Profile of Ethyl 4-(2-chloroacetamido)butanoate
Property Insights of Ethyl 4-(2-chloroacetamido)butanoate
The XLogP value of 0.6847 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 4-(2-chloroacetamido)butanoate. With a topological polar surface area (TPSA) of 55.4 Ų, Ethyl 4-(2-chloroacetamido)butanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 4-(2-chloroacetamido)butanoate 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-(2-chloroacetamido)butanoate?
The CAS number of Ethyl 4-(2-chloroacetamido)butanoate is 318271-37-3.
What is the molecular formula of Ethyl 4-(2-chloroacetamido)butanoate?
The molecular formula of Ethyl 4-(2-chloroacetamido)butanoate is C8H14ClNO3.
What is the molecular weight of Ethyl 4-(2-chloroacetamido)butanoate?
The molecular weight of Ethyl 4-(2-chloroacetamido)butanoate is 207.07 g/mol.
Where can I buy Ethyl 4-(2-chloroacetamido)butanoate?
You can request a quote for Ethyl 4-(2-chloroacetamido)butanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 4-(2-chloroacetamido)butanoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-(2-chloroacetamido)butanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.