5,5,5-Trifluoro-4-hydroxy-3-penten-2-one
TL;DR: 5,5,5-Trifluoro-4-hydroxy-3-penten-2-one (CAS 453-33-8) is a chemical compound with molecular formula C5H5F3O2 and molecular weight 154.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,5,5-trifluoro-4-hydroxypent-3-en-2-one
Also Known As: 2-(2-methylbutoxymethyl)oxirane, Copper(II) trifluoroacetylacetonate, 5,5,5-trifluoro-4-hydroxy-3-penten-2-one, 5,5,5-trifluoro-4-hydroxypent-3-en-2-one, Magnesium trifluoroacetylacetonate hydrate
| Molecular Formula | C5H5F3O2 |
|---|---|
| Molecular Weight | 154.02 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 154.02417 |
| Heavy Atoms | 10 |
| Complexity | 168.0 |
Chemical Identifiers
| CAS Number | 453-33-8 |
|---|---|
| SMILES | CC(=O)C=C(C(F)(F)F)O |
| InChIKey | HZWABPCDJWBJSC-UHFFFAOYSA-N |
Product Overview
5,5,5-Trifluoro-4-hydroxy-3-penten-2-one (CAS 453-33-8), with molecular formula C5H5F3O2 and molecular weight 154.02 g/mol. IUPAC: 5,5,5-trifluoro-4-hydroxypent-3-en-2-one.
Chemical Property Profile of 5,5,5-Trifluoro-4-hydroxy-3-penten-2-one
Property Insights of 5,5,5-Trifluoro-4-hydroxy-3-penten-2-one
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5,5,5-Trifluoro-4-hydroxy-3-penten-2-one. With a topological polar surface area (TPSA) of 37.3 Ų, 5,5,5-Trifluoro-4-hydroxy-3-penten-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5,5,5-Trifluoro-4-hydroxy-3-penten-2-one has 1 hydrogen bond donor(s) and 5 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 5,5,5-Trifluoro-4-hydroxy-3-penten-2-one?
The CAS number of 5,5,5-Trifluoro-4-hydroxy-3-penten-2-one is 453-33-8.
What is the molecular formula of 5,5,5-Trifluoro-4-hydroxy-3-penten-2-one?
The molecular formula of 5,5,5-Trifluoro-4-hydroxy-3-penten-2-one is C5H5F3O2.
What is the molecular weight of 5,5,5-Trifluoro-4-hydroxy-3-penten-2-one?
The molecular weight of 5,5,5-Trifluoro-4-hydroxy-3-penten-2-one is 154.02 g/mol.
Where can I buy 5,5,5-Trifluoro-4-hydroxy-3-penten-2-one?
You can request a quote for 5,5,5-Trifluoro-4-hydroxy-3-penten-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,5,5-Trifluoro-4-hydroxy-3-penten-2-one?
Yes, KEHONG BIO provides custom synthesis services for 5,5,5-Trifluoro-4-hydroxy-3-penten-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.