(3E)-5-bromo-1,1,1-trifluoro-4-morpholin-4-ylpent-3-en-2-one
TL;DR: (3E)-5-bromo-1,1,1-trifluoro-4-morpholin-4-ylpent-3-en-2-one (CAS 1186025-39-7) is a chemical compound with molecular formula C9H11BrF3NO2 and molecular weight 300.99252 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-5-bromo-1,1,1-trifluoro-4-morpholin-4-ylpent-3-en-2-one
Also Known As: 5-bromo-1,1,1-trifluoro-4-(morpholin-4-yl)pent-3-en-2-one, J2.865.964D, 5-bromo-1,1,1-trifluoro-4-morpholino-pent-3-en-2-one, (3E)-5-bromo-1,1,1-trifluoro-4-morpholin-4-ylpent-3-en-2-one, 2-Morpholino-3-bromo-1-propenyl(trifluoromethyl) ketone
Technical Specifications
| Molecular Formula | C9H11BrF3NO2 |
| Molecular Weight | 300.99252 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 300.99252 Da |
| Heavy Atoms | 16 |
| Complexity | 285.0 |
| SMILES | C1COCCN1/C(=C/C(=O)C(F)(F)F)/CBr |
| InChIKey | GXJOWVIDQBCAPP-FNORWQNLSA-N |
Chemical Property Profile of (3E)-5-bromo-1,1,1-trifluoro-4-morpholin-4-ylpent-3-en-2-one
Property Insights of (3E)-5-bromo-1,1,1-trifluoro-4-morpholin-4-ylpent-3-en-2-one
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3E)-5-bromo-1,1,1-trifluoro-4-morpholin-4-ylpent-3-en-2-one. With a topological polar surface area (TPSA) of 29.5 Ų, (3E)-5-bromo-1,1,1-trifluoro-4-morpholin-4-ylpent-3-en-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3E)-5-bromo-1,1,1-trifluoro-4-morpholin-4-ylpent-3-en-2-one has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of (3E)-5-bromo-1,1,1-trifluoro-4-morpholin-4-ylpent-3-en-2-one?
The CAS number of (3E)-5-bromo-1,1,1-trifluoro-4-morpholin-4-ylpent-3-en-2-one is 1186025-39-7.
What is the molecular formula of (3E)-5-bromo-1,1,1-trifluoro-4-morpholin-4-ylpent-3-en-2-one?
The molecular formula of (3E)-5-bromo-1,1,1-trifluoro-4-morpholin-4-ylpent-3-en-2-one is C9H11BrF3NO2.
What is the molecular weight of (3E)-5-bromo-1,1,1-trifluoro-4-morpholin-4-ylpent-3-en-2-one?
The molecular weight of (3E)-5-bromo-1,1,1-trifluoro-4-morpholin-4-ylpent-3-en-2-one is 300.99252 g/mol.
Where can I buy (3E)-5-bromo-1,1,1-trifluoro-4-morpholin-4-ylpent-3-en-2-one?
You can request a quote for (3E)-5-bromo-1,1,1-trifluoro-4-morpholin-4-ylpent-3-en-2-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (3E)-5-bromo-1,1,1-trifluoro-4-morpholin-4-ylpent-3-en-2-one?
Yes, CoreyChem provides custom synthesis services for (3E)-5-bromo-1,1,1-trifluoro-4-morpholin-4-ylpent-3-en-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.