Ethyl 3-amino-4-(ethylamino)benzoate
TL;DR: Ethyl 3-amino-4-(ethylamino)benzoate (CAS 202131-30-4) is a chemical compound with molecular formula C11H16N2O2 and molecular weight 208.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-amino-4-(ethylamino)benzoate
Also Known As: ethyl 3-amino-4-(ethylamino)benzoate, 3-Amino-4-ethylamino-benzoic acid ethyl ester, Ethyl 3-amino-4-ethylaminobenzoate, ethyl3-amino-4-(ethylamino)benzoate, Benzoic acid, 3-amino-4-(ethylamino)-, ethyl ester
| Molecular Formula | C11H16N2O2 |
|---|---|
| Molecular Weight | 208.12 g/mol |
| LogP | 1.8773 |
| Topological Polar Surface Area | 64.35 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 208.12119 |
| Heavy Atoms | 15 |
| Complexity | 350.4412 |
Chemical Identifiers
| CAS Number | 202131-30-4 |
|---|---|
| SMILES | CCNC1=C(C=C(C=C1)C(=O)OCC)N |
Product Overview
Ethyl 3-amino-4-(ethylamino)benzoate (CAS 202131-30-4), with molecular formula C11H16N2O2 and molecular weight 208.12 g/mol. IUPAC: ethyl 3-amino-4-(ethylamino)benzoate.
Chemical Property Profile of Ethyl 3-amino-4-(ethylamino)benzoate
Property Insights of Ethyl 3-amino-4-(ethylamino)benzoate
The XLogP value of 1.8773 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 3-amino-4-(ethylamino)benzoate. The TPSA of 64.35 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 3-amino-4-(ethylamino)benzoate. Following Lipinski's Rule of Five, Ethyl 3-amino-4-(ethylamino)benzoate has 2 hydrogen bond donor(s) and 4 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 3-amino-4-(ethylamino)benzoate?
The CAS number of Ethyl 3-amino-4-(ethylamino)benzoate is 202131-30-4.
What is the molecular formula of Ethyl 3-amino-4-(ethylamino)benzoate?
The molecular formula of Ethyl 3-amino-4-(ethylamino)benzoate is C11H16N2O2.
What is the molecular weight of Ethyl 3-amino-4-(ethylamino)benzoate?
The molecular weight of Ethyl 3-amino-4-(ethylamino)benzoate is 208.12 g/mol.
Where can I buy Ethyl 3-amino-4-(ethylamino)benzoate?
You can request a quote for Ethyl 3-amino-4-(ethylamino)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 3-amino-4-(ethylamino)benzoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 3-amino-4-(ethylamino)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.