2-(Methylthio)-5-(phenylmethoxy)-4-pyrimidinone 4874-30-0 5-(Benzyloxy)-2-(methylthio)-4-pyrimidinol NSC 94996 CAS 4874-30-0
| CAS No. | 4874-30-0 |
| Molecular Formula | C12H12N2O2S |
| Molecular Weight | 248.30 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
As a certified reference material (CRM), 2-(Methylthio)-5-(phenylmethoxy)-4-pyrimidinone 4874-30-0 5-(Benzyloxy)-2-(methylthio)-4-pyrimidinol NSC 94996 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.
2-(Methylthio)-5-(phenylmethoxy)-4-pyrimidinone 4874-30-0 5-(Benzyloxy)-2-(methylthio)-4-pyrimidinol NSC 94996 (CAS 4874-30-0), molecular formula C12H12N2O2S and molecular weight 248.30 g/mol, is a CATO reference standard with documented purity and traceability.
Based on its molecular formula C12H12N2O2S, 2-(Methylthio)-5-(phenylmethoxy)-4-pyrimidinone 4874-30-0 5-(Benzyloxy)-2-(methylthio)-4-pyrimidinol NSC 94996 contains a nitrogen-containing heterocyclic scaffold, an amide group, a sulfone group, a hydroxyl group, an ether linkage; these features give the compound characteristic absorption bands in UV spectroscopy. The molecular weight of 248.30 g/mol is directly relevant to the identification of the molecular ion in mass spectrometry. The high carbon-to-hydrogen ratio imparts good lipophilicity, allowing liquid-liquid extraction with non-polar solvents such as n-hexane or ethyl acetate.
Recommended for analytical method development and validation; each product is supplied with a full Certificate of Analysis (COA) ensuring ISO 17034 metrological traceability.
Physical & Chemical Properties
| Molecular Formula | C12H12N2O2S |
| Molecular Weight | 248.30 g/mol |
| Purity | 97%+ |
| Storage | Store at 2-8°C, protect from light, keep sealed and dry |
| Solubility (reference) | Soluble in DMSO, DMF, methanol |
| Stability | May oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light; Hygroscopic; reseal immediately after opening |
| Degree of Unsaturation (DBE) | 8.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1958 |
| Nitrogen Atoms | 2 |
| Sulfur Atoms | 1 |
Related Methylthio Standards
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- 4,4'-Di(methylthio)-2,2'-bipyridine (CAS 101028-38-0)
- 3-Benzyl-2-(methylthio)pyrimidine-4(3H)-thione (CAS 89185-14-8)
- 2-(Methylthio)-5-(trifluoromethoxy)benzo[d]oxazole (CAS 909854-66-6)
- (E)-1-(3-(Methylthio)pyrrolidin-1-yl)-3-phenylprop-2-en-1-one (CAS 1798397-36-0)
- 1253792-66-3 3210AD 7-(Methylthio)-1-(prop-2-ynyl)-1H-pyrimido-[4,5-d][1,3]oxazine-2,4-dione C10H7N3O3S (CAS 1253792-66-3)
Recommended Standards
- 2-{2-[(4-methylphenyl)amino]-1,3-thiazol-4-yl}acetic acid 436094-76-7 MS-9548 (CAS 436094-76-7)
- 893739-91-8 5-(4-Methanesulfonylphenyl)pyridin-2-amine MFCD06802733 (CAS 893739-91-8)
- 401899-98-7 (3Z)-5-Ethyl-1H-indole-2,3-dione 3-thiosemicarbazone MFCD01132212 (CAS 401899-98-7)
- Phenyl p-Toluenesulfonate (CAS 640-60-8)
- tert-Butyl 3-amino-4-bromobenzylcarbamate (CAS 2359953-13-0)
- N-(4-chlorophenyl)-3-(dimethylamino)-4-phenyl-1H-pyrazole-1-carbothioamide (CAS 321553-13-3)
- 4-Iodo-1-(2-(pyrrolidin-1-yl)ethyl)-1H-pyrazole (CAS 875798-85-9)
- 1,8-Naphthyridine-3,6-diamine (CAS 1177337-61-9)
- Dibutyltin-Dichloride (CAS 683-18-1)
- 3-Methylpiperidine-2,6-dione (CAS 29553-51-3)
- Tert-butyl 4-bromo-3,3-difluoropyrrolidine-1-carboxylate (CAS 2167546-25-8)
- 2-(Trimethylsiloxy)ethylmethacrylate (CAS 17407-09-9)
- Cholic Acid Impurity 39 (CAS CATO-C4X-116039)
- Semaglutide impurity 104(Fmoc-D-His-Aib) (CAS 2171211-18-8)
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