4-(2-Aminophenyl)-2-methylbut-3-yn-2-ol
TL;DR: 4-(2-Aminophenyl)-2-methylbut-3-yn-2-ol (CAS 157869-14-2) is a chemical compound with molecular formula C11H13NO and molecular weight 175.09972 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(2-aminophenyl)-2-methylbut-3-yn-2-ol
Also Known As: 4-(2-aminophenyl)-2-methyl-3-butyn-2-ol, 4-(2-aminophenyl)-2-methylbut-3-yn-2-ol, 4-(2-aminophenyl)-2-methyl-but-3-yn-2-ol, 2-(3-Hydroxy-3-methyl-1-butynyl)aniline, 2-Methyl-4-(2-aminophenyl)-3-butyne-2-ol
Technical Specifications
| Molecular Formula | C11H13NO |
| Molecular Weight | 175.09972 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 46.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 175.09972 Da |
| Heavy Atoms | 13 |
| Complexity | 233.0 |
| SMILES | CC(C)(C#CC1=CC=CC=C1N)O |
| InChIKey | OZOGDBPFACPLTR-UHFFFAOYSA-N |
Chemical Property Profile of 4-(2-Aminophenyl)-2-methylbut-3-yn-2-ol
Property Insights of 4-(2-Aminophenyl)-2-methylbut-3-yn-2-ol
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(2-Aminophenyl)-2-methylbut-3-yn-2-ol. With a topological polar surface area (TPSA) of 46.3 Ų, 4-(2-Aminophenyl)-2-methylbut-3-yn-2-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(2-Aminophenyl)-2-methylbut-3-yn-2-ol has 2 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-(2-Aminophenyl)-2-methylbut-3-yn-2-ol?
The CAS number of 4-(2-Aminophenyl)-2-methylbut-3-yn-2-ol is 157869-14-2.
What is the molecular formula of 4-(2-Aminophenyl)-2-methylbut-3-yn-2-ol?
The molecular formula of 4-(2-Aminophenyl)-2-methylbut-3-yn-2-ol is C11H13NO.
What is the molecular weight of 4-(2-Aminophenyl)-2-methylbut-3-yn-2-ol?
The molecular weight of 4-(2-Aminophenyl)-2-methylbut-3-yn-2-ol is 175.09972 g/mol.
Where can I buy 4-(2-Aminophenyl)-2-methylbut-3-yn-2-ol?
You can request a quote for 4-(2-Aminophenyl)-2-methylbut-3-yn-2-ol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-(2-Aminophenyl)-2-methylbut-3-yn-2-ol?
Yes, CoreyChem provides custom synthesis services for 4-(2-Aminophenyl)-2-methylbut-3-yn-2-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.