![4-{[(4-Chlorophenyl)methyl]amino}butanoic acid structure](/static/products/6568/656814-59-4.webp)
4-{[(4-Chlorophenyl)methyl]amino}butanoic acid
TL;DR: 4-{[(4-Chlorophenyl)methyl]amino}butanoic acid (CAS 656814-59-4) is a chemical compound with molecular formula C11H14ClNO2 and molecular weight 227.0713 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[(4-chlorophenyl)methylamino]butanoic acid
Also Known As: 4-{[(4-chlorophenyl)methyl]amino}butanoic acid, 4-((4-Chlorobenzyl)amino)butanoic acid, 4-[(4-chlorophenyl)methylamino]butanoic Acid, 4-[(4-chlorophenyl)methylammonio]butanoate, 4-[(4-CHLOROBENZYL)AMINO]BUTANOIC ACID
Technical Specifications
| Molecular Formula | C11H14ClNO2 |
| Molecular Weight | 227.0713 g/mol |
| XLogP | 0.1 |
| Topological Polar Surface Area (TPSA) | 56.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 227.0713 Da |
| Heavy Atoms | 15 |
| Complexity | 186.0 |
| SMILES | C1=CC(=CC=C1CNCCCC(=O)O)Cl |
| InChIKey | WWKRYTDDSNGEAB-UHFFFAOYSA-N |
Chemical Property Profile of 4-{[(4-Chlorophenyl)methyl]amino}butanoic acid
Property Insights of 4-{[(4-Chlorophenyl)methyl]amino}butanoic acid
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-{[(4-Chlorophenyl)methyl]amino}butanoic acid. With a topological polar surface area (TPSA) of 56.7 Ų, 4-{[(4-Chlorophenyl)methyl]amino}butanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-{[(4-Chlorophenyl)methyl]amino}butanoic acid has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-{[(4-Chlorophenyl)methyl]amino}butanoic acid?
The CAS number of 4-{[(4-Chlorophenyl)methyl]amino}butanoic acid is 656814-59-4.
What is the molecular formula of 4-{[(4-Chlorophenyl)methyl]amino}butanoic acid?
The molecular formula of 4-{[(4-Chlorophenyl)methyl]amino}butanoic acid is C11H14ClNO2.
What is the molecular weight of 4-{[(4-Chlorophenyl)methyl]amino}butanoic acid?
The molecular weight of 4-{[(4-Chlorophenyl)methyl]amino}butanoic acid is 227.0713 g/mol.
Where can I buy 4-{[(4-Chlorophenyl)methyl]amino}butanoic acid?
You can request a quote for 4-{[(4-Chlorophenyl)methyl]amino}butanoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-{[(4-Chlorophenyl)methyl]amino}butanoic acid?
Yes, CoreyChem provides custom synthesis services for 4-{[(4-Chlorophenyl)methyl]amino}butanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.