2,4,6-Trichloro-N-(2-isopropylphenyl)pyrimidine-5-carboxamide CAS 87848-01-9
| CAS No. | 87848-01-9 |
| Molecular Formula | C14H12Cl3N3O |
| Molecular Weight | 344.62 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
Structurally, 2,4,6-Trichloro-N-(2-isopropylphenyl)pyrimidine-5-carboxamide (C14H12Cl3N3O) contains a nitrogen-containing heterocyclic scaffold, an amide group, a hydroxyl group, an ether linkage, chlorine substitution. The molecule exhibits a degree of unsaturation (DBE) of 9.0, corresponding to approximately 9 ring(s) or double-bond equivalent(s). With a molecular weight of 344.62 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.
CATO supplies 2,4,6-Trichloro-N-(2-isopropylphenyl)pyrimidine-5-carboxamide (CAS 87848-01-9), a certified reference material (molecular formula C14H12Cl3N3O, MW 344.62 g/mol) for analytical method development and quality control.
Recommended for analytical method development and validation; each product is supplied with a full Certificate of Analysis (COA) ensuring ISO 17034 metrological traceability.
The assigned purity is verified by mass-balance and quantitative NMR (qNMR) approaches, with the expanded uncertainty reported at a 95% confidence level (k=2). Batch homogeneity and stability are independently assessed for every lot.
Physical & Chemical Properties
| Molecular Formula | C14H12Cl3N3O |
| Molecular Weight | 344.62 g/mol |
| Appearance | Pale yellow to yellow crystalline powder. (slight halide-like odor, low volatility) |
| Purity | 97%+ |
| Storage | Store at 2-8°C, 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) | 9.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1982 |
| Halogen Content | Cl-containing |
| Nitrogen Atoms | 3 |
Related Trichloro Standards
- N-(1,3,4-Trichloro-7-fluoro-9H-fluoren-2-yl)acetamide (CAS 10050-57-4)
- N-(2,2,2-trichloro-1-(pyrimidin-2-ylamino)ethyl)benzamide (CAS 256954-76-4)
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- Trichloro[3-(pentafluorophenyl)propyl]silane (CAS 78900-02-4)
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Recommended Standards
- 2-Chloro-N-(2,6-dichloro-4-methoxyphenyl)-N-phenylacetamide (CAS 136099-58-6)
- Nonadecylbenzene (CAS 29136-19-4)
- N-(2-Chloro-6-iodopyridin-3-yl)pivalamide (CAS 1138444-26-4)
- tert-Butyl 3-(bromomethyl)-5-chloro-1H-indole-1-carboxylate (CAS 168143-76-8)
- 1,3,4-Oxadiazole-2-acetic acid, 5-methyl-, lithium salt (1:1) (CAS 1384430-48-1)
- (r)-2-Amino-2-(3,5-dimethoxyphenyl)ethan-1-ol (CAS 1212858-72-4)
- 2-Phenyl-1,2,6-thiadiazinane 1,1-dioxide (CAS 210046-95-0)
- Rimegepant Impurity 89 (CAS CATO-C4X-248789)
- 3-Fluoro-3'-methoxy-[1,1'-biphenyl]-4-amine (CAS 867287-99-8)
- 2-Amino-N-(2-((3-chloro-4-methylphenyl)amino)-2-oxoethyl)acetamide hydrochloride (CAS 1836982-28-5)
- (2R,3S)-1-Benzhydryl-2-methylazetidin-3-ol (CAS 106859-42-1)
- 5-(6-Chlorooxazolo[5,4-b]pyridin-2-yl)-2-methoxyaniline (CAS 1354778-25-8)
- ISOTRIDECYL MYRISTATE (CAS 96518-24-0)
- Des-[Oct-γ-Glu-AEEA-AEEA]-Semaglutide (CAS CATO-C4X-2226112)
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