Benzoic acid, 2,4'-iminodi-, 4'-ethyl ester
TL;DR: Benzoic acid, 2,4'-iminodi-, 4'-ethyl ester (CAS 17332-29-5) is a chemical compound with molecular formula C16H15NO4 and molecular weight 285.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-ethoxycarbonylanilino)benzoic acid
Also Known As: 4'-Ethyl 2,4'-iminodibenzoate, Benzoic acid, 2,4'-iminodi-, 4'-ethyl ester, Benzoic acid, 2-((4-(ethoxycarbonyl)phenyl)amino)-, 2-(4-ethoxycarbonylanilino)benzoic acid, 2-[4-(Ethoxycarbonyl)anilino]benzoic acid
| Molecular Formula | C16H15NO4 |
|---|---|
| Molecular Weight | 285.10 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 75.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 285.1001 |
| Heavy Atoms | 21 |
| Complexity | 363.0 |
Chemical Identifiers
| CAS Number | 17332-29-5 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)NC2=CC=CC=C2C(=O)O |
| InChIKey | JRZXEBZNOVKDHT-UHFFFAOYSA-N |
Product Overview
Benzoic acid, 2,4'-iminodi-, 4'-ethyl ester (CAS 17332-29-5), with molecular formula C16H15NO4 and molecular weight 285.10 g/mol. IUPAC: 2-(4-ethoxycarbonylanilino)benzoic acid.
Chemical Property Profile of Benzoic acid, 2,4'-iminodi-, 4'-ethyl ester
Property Insights of Benzoic acid, 2,4'-iminodi-, 4'-ethyl ester
The XLogP value of 4.6 indicates that Benzoic acid, 2,4'-iminodi-, 4'-ethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzoic acid, 2,4'-iminodi-, 4'-ethyl ester. Following Lipinski's Rule of Five, Benzoic acid, 2,4'-iminodi-, 4'-ethyl ester has 2 hydrogen bond donor(s) and 5 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 Benzoic acid, 2,4'-iminodi-, 4'-ethyl ester?
The CAS number of Benzoic acid, 2,4'-iminodi-, 4'-ethyl ester is 17332-29-5.
What is the molecular formula of Benzoic acid, 2,4'-iminodi-, 4'-ethyl ester?
The molecular formula of Benzoic acid, 2,4'-iminodi-, 4'-ethyl ester is C16H15NO4.
What is the molecular weight of Benzoic acid, 2,4'-iminodi-, 4'-ethyl ester?
The molecular weight of Benzoic acid, 2,4'-iminodi-, 4'-ethyl ester is 285.10 g/mol.
Where can I buy Benzoic acid, 2,4'-iminodi-, 4'-ethyl ester?
You can request a quote for Benzoic acid, 2,4'-iminodi-, 4'-ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, 2,4'-iminodi-, 4'-ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 2,4'-iminodi-, 4'-ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.