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Acetic acid, [(4-iodophenyl)amino]oxo-, ethyl ester
TL;DR: Acetic acid, [(4-iodophenyl)amino]oxo-, ethyl ester (CAS 69066-01-9) is a chemical compound with molecular formula C10H10INO3 and molecular weight 318.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(4-iodoanilino)-2-oxoacetate
Also Known As: 4-Jod-oxanilsaeureaethylester, ethyl 2-(4-iodoanilino)-2-oxoacetate, Ethyl (4-iodoanilino)(oxo)acetate, Ethyl (4-iodophenyl)carbamoylformate, Acetic acid, [(4-iodophenyl)amino]oxo-, ethyl ester
| Molecular Formula | C10H10INO3 |
|---|---|
| Molecular Weight | 318.97 g/mol |
| LogP | 1.7928 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 318.97055 |
| Heavy Atoms | 15 |
| Complexity | 361.43518 |
Chemical Identifiers
| CAS Number | 69066-01-9 |
|---|---|
| SMILES | CCOC(=O)C(=O)NC1=CC=C(C=C1)I |
Product Overview
Acetic acid, [(4-iodophenyl)amino]oxo-, ethyl ester (CAS 69066-01-9), with molecular formula C10H10INO3 and molecular weight 318.97 g/mol. IUPAC: ethyl 2-(4-iodoanilino)-2-oxoacetate.
Chemical Property Profile of Acetic acid, [(4-iodophenyl)amino]oxo-, ethyl ester
Property Insights of Acetic acid, [(4-iodophenyl)amino]oxo-, ethyl ester
The XLogP value of 1.7928 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetic acid, [(4-iodophenyl)amino]oxo-, ethyl ester. With a topological polar surface area (TPSA) of 55.4 Ų, Acetic acid, [(4-iodophenyl)amino]oxo-, ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Acetic acid, [(4-iodophenyl)amino]oxo-, 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 Acetic acid, [(4-iodophenyl)amino]oxo-, ethyl ester?
The CAS number of Acetic acid, [(4-iodophenyl)amino]oxo-, ethyl ester is 69066-01-9.
What is the molecular formula of Acetic acid, [(4-iodophenyl)amino]oxo-, ethyl ester?
The molecular formula of Acetic acid, [(4-iodophenyl)amino]oxo-, ethyl ester is C10H10INO3.
What is the molecular weight of Acetic acid, [(4-iodophenyl)amino]oxo-, ethyl ester?
The molecular weight of Acetic acid, [(4-iodophenyl)amino]oxo-, ethyl ester is 318.97 g/mol.
Where can I buy Acetic acid, [(4-iodophenyl)amino]oxo-, ethyl ester?
You can request a quote for Acetic acid, [(4-iodophenyl)amino]oxo-, ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetic acid, [(4-iodophenyl)amino]oxo-, ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Acetic acid, [(4-iodophenyl)amino]oxo-, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.