5-(Trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7(1H)-one CAS 40775-91-5
| CAS No. | 40775-91-5 |
| Molecular Formula | C6H3F3N4O |
| Molecular Weight | 204.11 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
The occurrence of 5-(Trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7(1H)-one is closely related to an amide group, a hydroxyl group, an ether linkage, fluorine substitution, an aromatic ring system in its molecular formula, which determines its behaviour during synthesis, purification, or degradation.
5-(Trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7(1H)-one (CAS 40775-91-5) is a high-purity analytical reference standard with the molecular formula C6H3F3N4O and a molecular weight of 204.11 g/mol.
5-(Trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7(1H)-one (C6H3F3N4O) contains an amide group, a hydroxyl group, an ether linkage, fluorine substitution, an aromatic ring system. Halogen substitution raises its density and boiling point; these physicochemical properties determine the optimal preparation and storage of its standard solutions. Nitrogen-containing functional groups confer excellent ionization efficiency in positive-ion electrospray (ESI) mode, making the compound well suited to LC-MS/MS analysis.
This reference standard is suitable for quantitative analysis on major chromatographic platforms including HPLC, GC, LC-MS/MS, and GC-MS, serving as an external calibration standard or a system suitability test reference material.
CATO manufactures 5-(Trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7(1H)-one under ISO 17034:2016 accreditation with dual CNAS and ANAB accreditation. Each batch is characterized by orthogonal methods and supplied with a full Certificate of Analysis (COA), ensuring metrological traceability.
Physical & Chemical Properties
| Molecular Formula | C6H3F3N4O |
| Molecular Weight | 204.11 g/mol |
| Appearance | Off-white to pale yellow crystalline powder. (slight halide-like odor, faint amine-like odor, low volatility) |
| Purity | 97%+ |
| Storage | Store at 2-8°C, protect from light, keep tightly closed to prevent evaporation |
| Solubility (reference) | Soluble in DMSO, DMF, methanol |
| Stability | May oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light |
| Degree of Unsaturation (DBE) | 6.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1968 |
| Halogen Content | F-containing |
| Nitrogen Atoms | 4 |
Related Trifluoromethyl Standards
- 2-(Trifluoromethyl)-[1,2,4]triazolo[1,5-a][1,3,5]triazin-7-amine (CAS 1030420-77-9)
- 5-(Trifluoromethyl)oxazolo[4,5-b]pyridin-2(3H)-one (CAS 1092569-13-5)
- 3-(Trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one (CAS 140911-30-4)
- 2-(Trifluoromethyl)-6,9-dihydro-1h-purin-6-one (CAS 2268-14-6)
- 5-(Trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one (CAS 299918-83-5)
- 7-(Trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-5(4H)-one (CAS 244220-25-5)
- 8-(trifluoromethyl)-6,7-dihydro-1H-purin-6-one (CAS 2268-13-5)
- 4-(Trifluoromethyl)benzo[d][1,3]dioxol-2-one (CAS 933674-86-3)
Recommended Standards
- 2-Bromo-3-(piperidin-1-yl)prop-1-ene (CAS 37828-88-9)
- 6-Bromo-2,2-dimethylhexanenitrile (CAS 53545-96-3)
- (1R,5S)-3-bromo-8-methyl-8-azabicyclo[3.2.1]Octane (CAS 27809-79-6)
- 4-Bromobicyclo[2.2.2]octan-1-amine (CAS 135908-39-3)
- N-(4-methoxybenzyl)-1-(tetrahydrofuran-2-yl)methanamine hydrochloride (CAS 1048640-87-4)
- 2-Chloro-7-(trifluoromethyl)-1H-benzo[d]imidazole (CAS 1075753-27-3)
- tert-Butyl 4-((5-chloropyrimidin-2-yl)amino)piperidine-1-carboxylate (CAS 1261235-29-3)
- 4-(5-Bromopyridin-2-yl)thiomorpholine (CAS 223556-42-1)
- 5-Isobutyl-1,2,3-thiadiazole-4-carboxylic acid (CAS 1466047-39-1)
- 2-((3-(sec-Butyl)-4-oxo-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl)thio)-N-(2-chlorobenzyl)acetamide (CAS 1326859-59-9)
- 2-((2'H-spiro[cyclohexane-1,3'-isoquinolin]-1'(4'H)-ylidene)amino)acetic acid (CAS 500006-77-9)
- 2,2'-(9,9-Bis(6-bromohexyl)-9H -fluorene-2,7-diyl)bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolane) (CAS 851775-62-7)
- 3-(2-Nitrophenyl)-2-thioxothiazolidin-4-one (CAS 52494-41-4)
- Semaglutide Impurity 137 (x TFA Salt) (CAS CATO-C4X-2226137)
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