2-(Dimethylamino)-2-oxoethyl 2-amino-4-fluorobenzoate
TL;DR: 2-(Dimethylamino)-2-oxoethyl 2-amino-4-fluorobenzoate (CAS 923121-33-9) is a chemical compound with molecular formula C11H13FN2O3 and molecular weight 240.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(dimethylamino)-2-oxoethyl] 2-amino-4-fluorobenzoate
Also Known As: 2-(Dimethylamino)-2-oxoethyl 2-amino-4-fluorobenzoate, [2-(dimethylamino)-2-oxoethyl] 2-amino-4-fluorobenzoate
| Molecular Formula | C11H13FN2O3 |
|---|---|
| Molecular Weight | 240.09 g/mol |
| LogP | 0.6529 |
| Topological Polar Surface Area | 72.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 240.09102 |
| Heavy Atoms | 17 |
| Complexity | 446.3427 |
Chemical Identifiers
| CAS Number | 923121-33-9 |
|---|---|
| SMILES | CN(C)C(=O)COC(=O)C1=C(C=C(C=C1)F)N |
Product Overview
2-(Dimethylamino)-2-oxoethyl 2-amino-4-fluorobenzoate (CAS 923121-33-9), with molecular formula C11H13FN2O3 and molecular weight 240.09 g/mol. IUPAC: [2-(dimethylamino)-2-oxoethyl] 2-amino-4-fluorobenzoate.
Chemical Property Profile of 2-(Dimethylamino)-2-oxoethyl 2-amino-4-fluorobenzoate
Property Insights of 2-(Dimethylamino)-2-oxoethyl 2-amino-4-fluorobenzoate
The XLogP value of 0.6529 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Dimethylamino)-2-oxoethyl 2-amino-4-fluorobenzoate. The TPSA of 72.63 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(Dimethylamino)-2-oxoethyl 2-amino-4-fluorobenzoate. Following Lipinski's Rule of Five, 2-(Dimethylamino)-2-oxoethyl 2-amino-4-fluorobenzoate has 1 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 2-(Dimethylamino)-2-oxoethyl 2-amino-4-fluorobenzoate?
The CAS number of 2-(Dimethylamino)-2-oxoethyl 2-amino-4-fluorobenzoate is 923121-33-9.
What is the molecular formula of 2-(Dimethylamino)-2-oxoethyl 2-amino-4-fluorobenzoate?
The molecular formula of 2-(Dimethylamino)-2-oxoethyl 2-amino-4-fluorobenzoate is C11H13FN2O3.
What is the molecular weight of 2-(Dimethylamino)-2-oxoethyl 2-amino-4-fluorobenzoate?
The molecular weight of 2-(Dimethylamino)-2-oxoethyl 2-amino-4-fluorobenzoate is 240.09 g/mol.
Where can I buy 2-(Dimethylamino)-2-oxoethyl 2-amino-4-fluorobenzoate?
You can request a quote for 2-(Dimethylamino)-2-oxoethyl 2-amino-4-fluorobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Dimethylamino)-2-oxoethyl 2-amino-4-fluorobenzoate?
Yes, KEHONG BIO provides custom synthesis services for 2-(Dimethylamino)-2-oxoethyl 2-amino-4-fluorobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.