(3-Chloro-benzoylamino)-acetic acid ethyl ester
TL;DR: (3-Chloro-benzoylamino)-acetic acid ethyl ester (CAS 66824-95-1) 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 2-[(3-chlorobenzoyl)amino]acetate
Also Known As: ethyl N-(3-chlorobenzoyl)glycinate, Ethyl (3-chlorobenzoyl)glycinate, ethyl 2-[(3-chlorophenyl)formamido]acetate, ethyl 2-[(3-chlorobenzoyl)amino]acetate, Ethyl 2-(3-chlorobenzamido)acetate
| Molecular Formula | C11H12ClNO3 |
|---|---|
| Molecular Weight | 241.05 g/mol |
| LogP | 1.6329 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 241.05057 |
| Heavy Atoms | 16 |
| Complexity | 392.57098 |
Chemical Identifiers
| CAS Number | 66824-95-1 |
|---|---|
| SMILES | CCOC(=O)CNC(=O)C1=CC(=CC=C1)Cl |
Product Overview
(3-Chloro-benzoylamino)-acetic acid ethyl ester (CAS 66824-95-1), with molecular formula C11H12ClNO3 and molecular weight 241.05 g/mol. IUPAC: ethyl 2-[(3-chlorobenzoyl)amino]acetate.
Chemical Property Profile of (3-Chloro-benzoylamino)-acetic acid ethyl ester
Property Insights of (3-Chloro-benzoylamino)-acetic acid ethyl ester
The XLogP value of 1.6329 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3-Chloro-benzoylamino)-acetic acid ethyl ester. With a topological polar surface area (TPSA) of 55.4 Ų, (3-Chloro-benzoylamino)-acetic acid ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3-Chloro-benzoylamino)-acetic acid ethyl ester 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 (3-Chloro-benzoylamino)-acetic acid ethyl ester?
The CAS number of (3-Chloro-benzoylamino)-acetic acid ethyl ester is 66824-95-1.
What is the molecular formula of (3-Chloro-benzoylamino)-acetic acid ethyl ester?
The molecular formula of (3-Chloro-benzoylamino)-acetic acid ethyl ester is C11H12ClNO3.
What is the molecular weight of (3-Chloro-benzoylamino)-acetic acid ethyl ester?
The molecular weight of (3-Chloro-benzoylamino)-acetic acid ethyl ester is 241.05 g/mol.
Where can I buy (3-Chloro-benzoylamino)-acetic acid ethyl ester?
You can request a quote for (3-Chloro-benzoylamino)-acetic acid ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3-Chloro-benzoylamino)-acetic acid ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for (3-Chloro-benzoylamino)-acetic acid ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.