Tolibut
TL;DR: Tolibut (CAS 28311-38-8) is a chemical compound with molecular formula C11H15NO2 and molecular weight 193.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-amino-3-(4-methylphenyl)butanoic acid
Also Known As: Tolibut, 4-amino-3-(4-methylphenyl)butanoic acid, BUTRALIN, (R)-4-Amino-3-p-tolylbutanoic acid, (S)-4-Amino-3-p-tolylbutanoic acid
| Molecular Formula | C11H15NO2 |
|---|---|
| Molecular Weight | 193.11 g/mol |
| LogP | -1.2 |
| Topological Polar Surface Area | 63.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 193.11028 |
| Heavy Atoms | 14 |
| Complexity | 186.0 |
Chemical Identifiers
| CAS Number | 28311-38-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(CC(=O)O)CN |
| InChIKey | MSZRPURXKHMSFF-UHFFFAOYSA-N |
Product Overview
Tolibut (CAS 28311-38-8), with molecular formula C11H15NO2 and molecular weight 193.11 g/mol. IUPAC: 4-amino-3-(4-methylphenyl)butanoic acid.
Chemical Property Profile of Tolibut
Property Insights of Tolibut
The XLogP value of -1.2 indicates that Tolibut 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 Tolibut. Following Lipinski's Rule of Five, Tolibut 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
Frequently Asked Questions
What is the CAS number of Tolibut?
The CAS number of Tolibut is 28311-38-8.
What is the molecular formula of Tolibut?
The molecular formula of Tolibut is C11H15NO2.
What is the molecular weight of Tolibut?
The molecular weight of Tolibut is 193.11 g/mol.
Where can I buy Tolibut?
You can request a quote for Tolibut directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tolibut?
Yes, KEHONG BIO provides custom synthesis services for Tolibut and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.