Benzoic acid, 2-((2,3-dimethylphenyl)amino)-, ethoxymethyl ester
TL;DR: Benzoic acid, 2-((2,3-dimethylphenyl)amino)-, ethoxymethyl ester (CAS 29098-16-6) is a chemical compound with molecular formula C18H21NO3 and molecular weight 299.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethoxymethyl 2-(2,3-dimethylanilino)benzoate
Also Known As: ethoxymethyl 2-(2,3-dimethylanilino)benzoate, Ethoxymethyl 2-((2,3-dimethylphenyl)amino)benzoate, Benzoic acid, 2-((2,3-dimethylphenyl)amino)-, ethoxymethyl ester, 3-Carbamoyl-1-ethyl-6-hydroxy-4-picolin-2-one, Benzoic acid,2-[(2,3-dimethylphenyl)amino]-, ethoxymethyl ester
| Molecular Formula | C18H21NO3 |
|---|---|
| Molecular Weight | 299.15 g/mol |
| LogP | 5.8 |
| Topological Polar Surface Area | 47.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 299.15213 |
| Heavy Atoms | 22 |
| Complexity | 347.0 |
Chemical Identifiers
| CAS Number | 29098-16-6 |
|---|---|
| SMILES | CCOCOC(=O)C1=CC=CC=C1NC2=CC=CC(=C2C)C |
| InChIKey | CLWUZCKPXYACHA-UHFFFAOYSA-N |
Product Overview
Benzoic acid, 2-((2,3-dimethylphenyl)amino)-, ethoxymethyl ester (CAS 29098-16-6), with molecular formula C18H21NO3 and molecular weight 299.15 g/mol. IUPAC: ethoxymethyl 2-(2,3-dimethylanilino)benzoate.
Chemical Property Profile of Benzoic acid, 2-((2,3-dimethylphenyl)amino)-, ethoxymethyl ester
Property Insights of Benzoic acid, 2-((2,3-dimethylphenyl)amino)-, ethoxymethyl ester
The XLogP value of 5.8 indicates that Benzoic acid, 2-((2,3-dimethylphenyl)amino)-, ethoxymethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.6 Ų, Benzoic acid, 2-((2,3-dimethylphenyl)amino)-, ethoxymethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzoic acid, 2-((2,3-dimethylphenyl)amino)-, ethoxymethyl ester has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Benzoic acid, 2-((2,3-dimethylphenyl)amino)-, ethoxymethyl ester?
The CAS number of Benzoic acid, 2-((2,3-dimethylphenyl)amino)-, ethoxymethyl ester is 29098-16-6.
What is the molecular formula of Benzoic acid, 2-((2,3-dimethylphenyl)amino)-, ethoxymethyl ester?
The molecular formula of Benzoic acid, 2-((2,3-dimethylphenyl)amino)-, ethoxymethyl ester is C18H21NO3.
What is the molecular weight of Benzoic acid, 2-((2,3-dimethylphenyl)amino)-, ethoxymethyl ester?
The molecular weight of Benzoic acid, 2-((2,3-dimethylphenyl)amino)-, ethoxymethyl ester is 299.15 g/mol.
Where can I buy Benzoic acid, 2-((2,3-dimethylphenyl)amino)-, ethoxymethyl ester?
You can request a quote for Benzoic acid, 2-((2,3-dimethylphenyl)amino)-, ethoxymethyl 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-((2,3-dimethylphenyl)amino)-, ethoxymethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 2-((2,3-dimethylphenyl)amino)-, ethoxymethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.