N,N-(Methyl-2-carboxyisopropyl)-4-fluoroaniline
TL;DR: N,N-(Methyl-2-carboxyisopropyl)-4-fluoroaniline (CAS 121043-32-1) is a chemical compound with molecular formula C11H14FNO2 and molecular weight 211.10086 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(4-fluoro-N-methylanilino)-2-methylpropanoic acid
Also Known As: N,N-Mcipfa, N,N-(Methyl-2-carboxyisopropyl)-4-fluoroaniline, 2-(4-fluoro-N-methylanilino)-2-methylpropanoic acid, Alanine, N-(4-fluorophenyl)-N,2-dimethyl-, N-(4-Fluorophenyl)-N,2-dimethylalanine
Technical Specifications
| Molecular Formula | C11H14FNO2 |
| Molecular Weight | 211.10086 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 40.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 211.10086 Da |
| Heavy Atoms | 15 |
| Complexity | 235.0 |
| SMILES | CC(C)(C(=O)O)N(C)C1=CC=C(C=C1)F |
| InChIKey | HGMZSLHSIZYJFQ-UHFFFAOYSA-N |
Chemical Property Profile of N,N-(Methyl-2-carboxyisopropyl)-4-fluoroaniline
Property Insights of N,N-(Methyl-2-carboxyisopropyl)-4-fluoroaniline
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,N-(Methyl-2-carboxyisopropyl)-4-fluoroaniline. With a topological polar surface area (TPSA) of 40.5 Ų, N,N-(Methyl-2-carboxyisopropyl)-4-fluoroaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N-(Methyl-2-carboxyisopropyl)-4-fluoroaniline 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 N,N-(Methyl-2-carboxyisopropyl)-4-fluoroaniline?
The CAS number of N,N-(Methyl-2-carboxyisopropyl)-4-fluoroaniline is 121043-32-1.
What is the molecular formula of N,N-(Methyl-2-carboxyisopropyl)-4-fluoroaniline?
The molecular formula of N,N-(Methyl-2-carboxyisopropyl)-4-fluoroaniline is C11H14FNO2.
What is the molecular weight of N,N-(Methyl-2-carboxyisopropyl)-4-fluoroaniline?
The molecular weight of N,N-(Methyl-2-carboxyisopropyl)-4-fluoroaniline is 211.10086 g/mol.
Where can I buy N,N-(Methyl-2-carboxyisopropyl)-4-fluoroaniline?
You can request a quote for N,N-(Methyl-2-carboxyisopropyl)-4-fluoroaniline directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N,N-(Methyl-2-carboxyisopropyl)-4-fluoroaniline?
Yes, CoreyChem provides custom synthesis services for N,N-(Methyl-2-carboxyisopropyl)-4-fluoroaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.