4,4,4-Trifluoro-1-phenylbut-2-yn-1-ol
TL;DR: 4,4,4-Trifluoro-1-phenylbut-2-yn-1-ol (CAS 128746-89-4) is a chemical compound with molecular formula C10H7F3O and molecular weight 200.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,4,4-trifluoro-1-phenylbut-2-yn-1-ol
Also Known As: 4,4,4-trifluoro-1-phenylbut-2-yn-1-ol, Benzenemethanol, a-(3,3,3-trifluoro-1-propynyl)-, 1-Phenyl-4,4,4-trifluoro-2-butyn-1-ol, 4,4,4-Trifluoro-1-phenyl-2-butyne-1-ol, 4,4,4-trifluoro-1-phenyl-but-2-yn-1-ol
| Molecular Formula | C10H7F3O |
|---|---|
| Molecular Weight | 200.04 g/mol |
| LogP | 2.2857 |
| Topological Polar Surface Area | 20.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 200.0449 |
| Heavy Atoms | 14 |
| Complexity | 345.11523 |
Chemical Identifiers
| CAS Number | 128746-89-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(C#CC(F)(F)F)O |
Product Overview
4,4,4-Trifluoro-1-phenylbut-2-yn-1-ol (CAS 128746-89-4), with molecular formula C10H7F3O and molecular weight 200.04 g/mol. IUPAC: 4,4,4-trifluoro-1-phenylbut-2-yn-1-ol.
Chemical Property Profile of 4,4,4-Trifluoro-1-phenylbut-2-yn-1-ol
Property Insights of 4,4,4-Trifluoro-1-phenylbut-2-yn-1-ol
The XLogP value of 2.2857 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,4,4-Trifluoro-1-phenylbut-2-yn-1-ol. With a topological polar surface area (TPSA) of 20.23 Ų, 4,4,4-Trifluoro-1-phenylbut-2-yn-1-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,4,4-Trifluoro-1-phenylbut-2-yn-1-ol has 1 hydrogen bond donor(s) and 1 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 4,4,4-Trifluoro-1-phenylbut-2-yn-1-ol?
The CAS number of 4,4,4-Trifluoro-1-phenylbut-2-yn-1-ol is 128746-89-4.
What is the molecular formula of 4,4,4-Trifluoro-1-phenylbut-2-yn-1-ol?
The molecular formula of 4,4,4-Trifluoro-1-phenylbut-2-yn-1-ol is C10H7F3O.
What is the molecular weight of 4,4,4-Trifluoro-1-phenylbut-2-yn-1-ol?
The molecular weight of 4,4,4-Trifluoro-1-phenylbut-2-yn-1-ol is 200.04 g/mol.
Where can I buy 4,4,4-Trifluoro-1-phenylbut-2-yn-1-ol?
You can request a quote for 4,4,4-Trifluoro-1-phenylbut-2-yn-1-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,4,4-Trifluoro-1-phenylbut-2-yn-1-ol?
Yes, KEHONG BIO provides custom synthesis services for 4,4,4-Trifluoro-1-phenylbut-2-yn-1-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.