3-(4-(Bromomethyl)-1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl)-6-(trifluoromethyl)pyrimidin-4(3H)-one CAS 1823183-65-8
| CAS No. | 1823183-65-8 |
| Molecular Formula | C11H7BrF6N4O |
| Molecular Weight | 405.09 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
The occurrence of 3-(4-(Bromomethyl)-1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl)-6-(trifluoromethyl)pyrimidin-4(3H)-one is closely related to a nitrogen-containing heterocyclic scaffold, an amide group, a hydroxyl group, an ether linkage, fluorine/bromine substitution in its molecular formula, which determines its behaviour during synthesis, purification, or degradation.
3-(4-(Bromomethyl)-1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl)-6-(trifluoromethyl)pyrimidin-4(3H)-one (CAS 1823183-65-8) is a high-purity analytical reference standard with the molecular formula C11H7BrF6N4O and a molecular weight of 405.09 g/mol.
Structurally, 3-(4-(Bromomethyl)-1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl)-6-(trifluoromethyl)pyrimidin-4(3H)-one (C11H7BrF6N4O) contains a nitrogen-containing heterocyclic scaffold, an amide group, a hydroxyl group, an ether linkage, fluorine/bromine substitution. The molecule exhibits a degree of unsaturation (DBE) of 7.0, corresponding to approximately 7 ring(s) or double-bond equivalent(s). With a molecular weight of 405.09 g/mol, it falls into the moderately-high-molecular-weight range. Nitrogen-containing functional groups confer excellent ionization efficiency in positive-ion electrospray (ESI) mode, making the compound well suited to LC-MS/MS analysis.
Recommended for analytical method development and validation; each product is supplied with a full Certificate of Analysis (COA) ensuring ISO 17034 metrological traceability.
As a certified reference material (CRM), 3-(4-(Bromomethyl)-1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl)-6-(trifluoromethyl)pyrimidin-4(3H)-one meets the metrological traceability requirements of ISO/IEC 17025 laboratories. Batch-to-batch consistency is monitored via control charts to guarantee comparable assigned values across lots.
Physical & Chemical Properties
| Molecular Formula | C11H7BrF6N4O |
| Molecular Weight | 405.09 g/mol |
| Appearance | Off-white to pale yellow crystalline powder. (slight halide-like odor, low volatility) |
| Purity | 97%+ |
| Storage | Store at room temperature, protect from light |
| 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) | 7.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1995 |
| Halogen Content | F/Br-containing |
| Nitrogen Atoms | 4 |
Related Bromomethyl Standards
- 1,3,5,5-Tris(bromomethyl)-2,4,6-trimethylbenzene 1,3,5-tris(bromomethyl)-2,4,6-trimethylbenzene 21988-87-4 (CAS 21988-87-4)
- 3-(3-(Bromomethyl)-5-iodophenyl)-3-(trifluoromethyl)-3H-diazirine (CAS 309250-32-6)
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- 3,5-Bis(bromomethyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenol (CAS 2096469-95-1)
- 2-(3-(Bromomethyl)phenyl)-4,5-diphenylthiazole (CAS 1217863-18-7)
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Recommended Standards
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- Ethyl 2-bromo-4-(3-bromobenzyl)thiazole-5-carboxylate (CAS 1206908-13-5)
- 1-[3-(propan-2-yl)phenyl]-1,3-diazinan-2-one (CAS 1552497-45-6)
- (S)-3-((S)-2-((S)-2-Acetamido-3-methylbutanamido)propanamido)-4-oxobutanoic acid (CAS 147837-52-3)
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- (7-Bromonaphthalen-2-yl)boronic acid (CAS 1337916-21-8)
- N-(Cyclopropylmethyl)-1-phenylpent-4-en-2-amine (CAS 35531-77-2)
- 216393-64-5 4 - Bromo - 2 - fluorophenylboronic acid 4-Bromo-2-fluorobenzeneboronic acid boronic acid, (4-bromo-2-fluorophenyl)- (CAS 216393-64-5)
- 4-(2-(P-tolyloxy)acetamido)butanoic acid (CAS 79133-23-6)
- Pipracil (CAS 61477-96-1)
- 1-(4-(3-Phenyl-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl)piperazin-1-yl)pentan-1-one (CAS 920217-83-0)
- Semaglutide impurity 66 (CAS CATO-C4X-222666)
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