TL;DR: Ethyl 2-amino-2-(4-fluorophenyl)acetate (CAS 1379444-87-7) is a chemical compound with molecular formula C10H12FNO2 and molecular weight 197.0852 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 2-amino-2-(4-fluorophenyl)acetate
Also Known As: Ethyl 2-amino-2-(4-fluorophenyl)acetate, Ethyl (s)-2-amino-2-(4-fluorophenyl)acetate, ETHYL2-AMINO-2-(4-FLUOROPHENYL)ACETATE, Benzeneacetic acid, alpha-amino-4-fluoro-, ethyl ester
| Molecular Formula | C10H12FNO2 |
| Molecular Weight | 197.0852 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 52.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 197.0852 Da |
| Heavy Atoms | 14 |
| Complexity | 191.0 |
| SMILES | CCOC(=O)C(C1=CC=C(C=C1)F)N |
| InChIKey | IGISMORTRUHEQV-UHFFFAOYSA-N |
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-amino-2-(4-fluorophenyl)acetate. With a topological polar surface area (TPSA) of 52.3 Ų, Ethyl 2-amino-2-(4-fluorophenyl)acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 2-amino-2-(4-fluorophenyl)acetate has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Ethyl 2-amino-2-(4-fluorophenyl)acetate is 1379444-87-7.
The molecular formula of Ethyl 2-amino-2-(4-fluorophenyl)acetate is C10H12FNO2.
The molecular weight of Ethyl 2-amino-2-(4-fluorophenyl)acetate is 197.0852 g/mol.
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