4-((2,4-Dioxo-3,4-dihydropyrimidin-1(2H)-yl)methyl)benzamide CAS 4116-44-3
| CAS No. | 4116-44-3 |
| Molecular Formula | C7H12ClN5 |
| Molecular Weight | N/A |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
Structurally, 4-((2,4-Dioxo-3,4-dihydropyrimidin-1(2H)-yl)methyl)benzamide (C7H12ClN5C12H14N2Cl) contains a nitrogen-containing heterocyclic scaffold, a nitrile group, chlorine substitution. The molecule exhibits a degree of unsaturation (DBE) of 9.5, corresponding to approximately 9 ring(s) or double-bond equivalent(s). With a molecular weight of 423.37 g/mol, it falls into the moderately-high-molecular-weight range. The aromatic system may exhibit native fluorescence, enabling detection with a fluorescence detector (FLD).
4-((2,4-Dioxo-3,4-dihydropyrimidin-1(2H)-yl)methyl)benzamide (CAS 4116-44-3), molecular formula C7H12ClN5C12H14N2Cl and molecular weight 423.37 g/mol, is a CATO reference standard with documented purity and traceability.
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 | C7H12ClN5 C12H14N2 2*Cl |
| Molecular Weight | 423.37 g/mol |
| Appearance | Pale yellow to 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) | 9.5 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1958 |
| Halogen Content | Cl-containing |
| Nitrogen Atoms | 7 |
Related Dioxo Standards
- 3-(1,3-Dioxo-2,3,3a,4,7,7a-hexahydro-1H-isoindol-2-yl)propanenitrile (CAS 100060-32-0)
- 2,4-Dioxo-7-(propan-2-yl)-1-propyl-1h,2h,3h,4h-pyrido[2,3-d]pyrimidine-5-carboxylic acid (CAS 1000932-57-9)
- 1-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidine-7-carboxylic acid (CAS 1000933-15-2)
- 1,3-Dioxo-2-(4-(propoxycarbonyl)phenyl)isoindoline-5-carboxylic acid (CAS 100162-30-9)
- 4-(4-Methyl-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)benzoic acid (CAS 1004085-26-0)
- Methyl 2-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)-5-ethylthiophene-3-carboxylate (CAS 1005107-97-0)
- 3-(2,5-Dioxo-1-propylimidazolidin-4-yl)propanoic acid (CAS 1008075-32-8)
- 2-(1,3-Dioxo-2,3,3a,4,7,7a-hexahydro-1h-isoindol-2-yl)propanoic acid (CAS 1008606-51-6)
Recommended Standards
- 2-Chloro-N-(2,2,4-trimethyl-2,3-dihydro-1-benzofuran-7-yl)acetamide (CAS 866150-23-4)
- 5,7-Difluoro-2,3-dihydrobenzofuran-3-amine (CAS 939757-44-5)
- 2-(4-methoxyphenyl)-1-methyl-6-oxopiperidine-3-carboxylic acid (CAS 75810-44-5)
- Thioquinox (CAS 93-75-4)
- 3-[[(4-Fluorophenyl)methyl]thio]-1,2,4-thiadiazol-5-amine (CAS 446054-00-8)
- 1-(Difluoromethyl)-5-iodo-1H-imidazole (CAS 2172559-98-5)
- N,N-Dimethyl-2-(vinyloxy)ethanamine (CAS 3622-76-2)
- 3-[(2-Chlorophenyl)methyl]-3,4-dihydro-2H-1,3-benzothiazine-2,4-dione (CAS 338401-61-9)
- Pyranocumarin (CAS 518-20-7)
- Copper Peptide ยท2 acetate salt (CAS 130120-57-9)
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