4-Amino-4-phenylbutanoic acid
TL;DR: 4-Amino-4-phenylbutanoic acid (CAS 1011-60-5) is a chemical compound with molecular formula C10H13NO2 and molecular weight 179.09464 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-amino-4-phenylbutanoic acid
Also Known As: 4-amino-4-phenylbutanoic acid, gamma-Phenyl GABA, 4-Amino-4-phenyl-butyric acid, 4-Amino-4-phenylbutyric acid, (R)-4-Amino-4-phenylbutanoic acid
Application Areas
Top 5 of 8 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C10H13NO2 |
| Molecular Weight | 179.09464 g/mol |
| XLogP | -1.6 |
| Topological Polar Surface Area (TPSA) | 63.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 179.09464 Da |
| Heavy Atoms | 13 |
| Complexity | 164.0 |
| SMILES | C1=CC=C(C=C1)C(CCC(=O)O)N |
| InChIKey | QCHLDIVWWGHNQB-UHFFFAOYSA-N |
Chemical Property Profile of 4-Amino-4-phenylbutanoic acid
Property Insights of 4-Amino-4-phenylbutanoic acid
The XLogP value of -1.6 indicates that 4-Amino-4-phenylbutanoic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 63.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Amino-4-phenylbutanoic acid. Following Lipinski's Rule of Five, 4-Amino-4-phenylbutanoic acid has 2 hydrogen bond donor(s) and 3 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-Amino-4-phenylbutanoic acid?
The CAS number of 4-Amino-4-phenylbutanoic acid is 1011-60-5.
What is the molecular formula of 4-Amino-4-phenylbutanoic acid?
The molecular formula of 4-Amino-4-phenylbutanoic acid is C10H13NO2.
What is the molecular weight of 4-Amino-4-phenylbutanoic acid?
The molecular weight of 4-Amino-4-phenylbutanoic acid is 179.09464 g/mol.
Where can I buy 4-Amino-4-phenylbutanoic acid?
You can request a quote for 4-Amino-4-phenylbutanoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-Amino-4-phenylbutanoic acid?
Yes, CoreyChem provides custom synthesis services for 4-Amino-4-phenylbutanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.