Methyl 2-amino-4,5-diethoxybenzoate
TL;DR: Methyl 2-amino-4,5-diethoxybenzoate (CAS 20197-71-1) is a chemical compound with molecular formula C12H17NO4 and molecular weight 239.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-amino-4,5-diethoxybenzoate
Also Known As: methyl 2-amino-4,5-diethoxybenzoate, 2-Amino-4,5-diethoxy-benzoic acid methyl ester, Methyl 2-amino-4,5-diethoxy-benzoate, (3-formyl-1H-indol-1-yl)acetonitrile, METHYL2-AMINO-4,5-DIETHOXYBENZOATE
| Molecular Formula | C12H17NO4 |
|---|---|
| Molecular Weight | 239.12 g/mol |
| LogP | 1.8528 |
| Topological Polar Surface Area | 70.78 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 239.11575 |
| Heavy Atoms | 17 |
| Complexity | 403.73724 |
Chemical Identifiers
| CAS Number | 20197-71-1 |
|---|---|
| SMILES | CCOC1=C(C=C(C(=C1)C(=O)OC)N)OCC |
Product Overview
Methyl 2-amino-4,5-diethoxybenzoate (CAS 20197-71-1), with molecular formula C12H17NO4 and molecular weight 239.12 g/mol. IUPAC: methyl 2-amino-4,5-diethoxybenzoate.
Chemical Property Profile of Methyl 2-amino-4,5-diethoxybenzoate
Property Insights of Methyl 2-amino-4,5-diethoxybenzoate
The XLogP value of 1.8528 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-amino-4,5-diethoxybenzoate. The TPSA of 70.78 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-amino-4,5-diethoxybenzoate. Following Lipinski's Rule of Five, Methyl 2-amino-4,5-diethoxybenzoate has 1 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 Methyl 2-amino-4,5-diethoxybenzoate?
The CAS number of Methyl 2-amino-4,5-diethoxybenzoate is 20197-71-1.
What is the molecular formula of Methyl 2-amino-4,5-diethoxybenzoate?
The molecular formula of Methyl 2-amino-4,5-diethoxybenzoate is C12H17NO4.
What is the molecular weight of Methyl 2-amino-4,5-diethoxybenzoate?
The molecular weight of Methyl 2-amino-4,5-diethoxybenzoate is 239.12 g/mol.
Where can I buy Methyl 2-amino-4,5-diethoxybenzoate?
You can request a quote for Methyl 2-amino-4,5-diethoxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-amino-4,5-diethoxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-amino-4,5-diethoxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.