Methyl 3-amino-3-(2-fluorophenyl)propanoate
TL;DR: Methyl 3-amino-3-(2-fluorophenyl)propanoate (CAS 1213444-17-7) 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.
methyl 3-amino-3-(2-fluorophenyl)propanoate
Also Known As: methyl 3-amino-3-(2-fluorophenyl)propanoate, Methyl-3-amino-3-(2-fluorophenyl)propionate, J2.816.340A, Methyl (s)-3-amino-3-(2-fluorophenyl)propanoate, 3-Amino-3-(2-fluorophenyl)propanoic acid methyl ester
Technical Specifications
| Molecular Formula | C10H12FNO2 |
| Molecular Weight | 197.0852 g/mol |
| XLogP | 0.7 |
| 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 | 199.0 |
| SMILES | COC(=O)CC(C1=CC=CC=C1F)N |
| InChIKey | SUVMVUFJILWDSU-UHFFFAOYSA-N |
Chemical Property Profile of Methyl 3-amino-3-(2-fluorophenyl)propanoate
Property Insights of Methyl 3-amino-3-(2-fluorophenyl)propanoate
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 3-amino-3-(2-fluorophenyl)propanoate. With a topological polar surface area (TPSA) of 52.3 Ų, Methyl 3-amino-3-(2-fluorophenyl)propanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 3-amino-3-(2-fluorophenyl)propanoate 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
What is the CAS number of Methyl 3-amino-3-(2-fluorophenyl)propanoate?
The CAS number of Methyl 3-amino-3-(2-fluorophenyl)propanoate is 1213444-17-7.
What is the molecular formula of Methyl 3-amino-3-(2-fluorophenyl)propanoate?
The molecular formula of Methyl 3-amino-3-(2-fluorophenyl)propanoate is C10H12FNO2.
What is the molecular weight of Methyl 3-amino-3-(2-fluorophenyl)propanoate?
The molecular weight of Methyl 3-amino-3-(2-fluorophenyl)propanoate is 197.0852 g/mol.
Where can I buy Methyl 3-amino-3-(2-fluorophenyl)propanoate?
You can request a quote for Methyl 3-amino-3-(2-fluorophenyl)propanoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Methyl 3-amino-3-(2-fluorophenyl)propanoate?
Yes, CoreyChem provides custom synthesis services for Methyl 3-amino-3-(2-fluorophenyl)propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.