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| SKU | Size | Availability |
Price | Qty |
|---|---|---|---|---|
|
I166855-100mg
|
100mg |
3
|
$19.90
|
|
|
I166855-250mg
|
250mg |
3
|
$37.90
|
|
|
I166855-1g
|
1g |
3
|
$114.90
|
|
| Synonyms | (S)-5-(Trifluoromethyl)pyrrolidin-2-one | BKONNPBZAYHNOV-VKHMYHEASA-N | BBL101941 | AKOS016015600 | EN300-227331 | SCHEMBL17113635 | (5S)-5-(Trifluoromethyl)pyrrolidin-2-one, 98%ee | MFCD22566326 | (5S)-5-(Trifluoromethyl)pyrrolidin-2-one | AT19173 | 1287 |
|---|---|
| Specifications & Purity | ≥97% |
| Storage Temp | Store at 2-8°C,Argon charged |
| Shipped In |
Wet ice This product requires cold chain shipping. Ground and other economy services are not available. |
Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Organoheterocyclic compounds |
| Class | Pyrrolidines |
| Subclass | Pyrrolidones |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Pyrrolidine-2-ones |
| Alternative Parents | Secondary carboxylic acid amides Lactams Azacyclic compounds Organonitrogen compounds Organofluorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl fluorides |
| Molecular Framework | Aliphatic heteromonocyclic compounds |
| Substituents | 2-pyrrolidone - Carboxamide group - Lactam - Secondary carboxylic acid amide - Carboxylic acid derivative - Azacycle - Organic oxide - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Alkyl halide - Hydrocarbon derivative - Alkyl fluoride - Aliphatic heteromonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as pyrrolidine-2-ones. These are pyrrolidines which bear a C=O group at position 2 of the pyrrolidine ring. |
| External Descriptors | Not available |
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| Activity Type | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
|---|
| Mechanism of Action | Action Type | target ID | Target Name | Target Type | Target Organism | Binding Site Name | References |
|---|
| IUPAC Name | (5S)-5-(trifluoromethyl)pyrrolidin-2-one |
|---|---|
| INCHI | InChI=1S/C5H6F3NO/c6-5(7,8)3-1-2-4(10)9-3/h3H,1-2H2,(H,9,10)/t3-/m0/s1 |
| InChIKey | BKONNPBZAYHNOV-VKHMYHEASA-N |
| Smiles | C1CC(=O)NC1C(F)(F)F |
| Isomeric SMILES | C1CC(=O)N[C@@H]1C(F)(F)F |
| WGK Germany | 3 |
| Molecular Weight | 153.1 |
| Reaxy-Rn | 27468567 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=27468567&ln= |
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Date | Item |
|---|---|---|---|
| Certificate of Analysis | Apr 03, 2025 | I166855 | |
| Certificate of Analysis | Apr 03, 2025 | I166855 | |
| Certificate of Analysis | Jan 14, 2023 | I166855 | |
| Certificate of Analysis | Jan 14, 2023 | I166855 | |
| Certificate of Analysis | Jan 14, 2023 | I166855 | |
| Certificate of Analysis | May 31, 2022 | I166855 |
| Sensitivity | Moisture sensitive. &air sensitive& heat sensitive |
|---|---|
| Melt Point(°C) | 98-105 °C |
| Molecular Weight | 153.100 g/mol |
| XLogP3 | 0.800 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 0 |
| Exact Mass | 153.04 Da |
| Monoisotopic Mass | 153.04 Da |
| Topological Polar Surface Area | 29.100 Ų |
| Heavy Atom Count | 10 |
| Formal Charge | 0 |
| Complexity | 153.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 1 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |