3-[(3-Chloro-4-Propoxyphenyl)Methyl]-5-Fluoro-1H-Pyrimidine-2,4-Dione CAS 102613-24-1
| CAS No. | 102613-24-1 |
| Molecular Formula | C14H14ClFN2O3 |
| Molecular Weight | 312.72 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
Under current pharmacopoeial and regulatory frameworks, quality-control requirements for this class of reference material explicitly involve the control of targets including 3-[(3-Chloro-4-Propoxyphenyl)Methyl]-5-Fluoro-1H-Pyrimidine-2,4-Dione.
3-[(3-Chloro-4-Propoxyphenyl)Methyl]-5-Fluoro-1H-Pyrimidine-2,4-Dione (CAS 102613-24-1) is a high-purity analytical reference standard with the molecular formula C14H14ClFN2O3 and a molecular weight of 312.72 g/mol.
Based on its molecular formula C14H14ClFN2O3, 3-[(3-Chloro-4-Propoxyphenyl)Methyl]-5-Fluoro-1H-Pyrimidine-2,4-Dione contains a nitrogen-containing heterocyclic scaffold, an amide group, a hydroxyl group, an ether linkage, fluorine/chlorine substitution; these features give the compound characteristic absorption bands in UV spectroscopy. The molecular weight of 312.72 g/mol is directly relevant to the identification of the molecular ion in mass spectrometry. 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.
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 | C14H14ClFN2O3 |
| Molecular Weight | 312.72 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, 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; Contains ester bond; hydrolyzes under strong alkaline conditions |
| Degree of Unsaturation (DBE) | 8.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1986 |
| Halogen Content | F/Cl-containing |
| Nitrogen Atoms | 2 |
Related Chloro Standards
- 3-[(3-Chloro-4-Propan-2-Yloxyphenyl)Methyl]-5-Fluoro-1H-Pyrimidine-2,4-Dione (CAS 102613-22-9)
- 1-(3-Chloro-5-(trifluoromethyl)pyridin-2-yl)-1,2,3,4-tetrahydroquinoline (CAS 1219967-13-1)
- Ethyl 7-chloro-1-cyclopropyl-6-fluoro-4-oxo-1,2,3,4-tetrahydro-1,8-naphthyridine-3-carboxylate (CAS 125290-81-5)
- 4-Chloro-2-(4-(trifluoromethyl)phenyl)-5,6,7,8-tetrahydroquinazoline (CAS 1303652-63-2)
- Ethyl 4-(3-chloro-4-fluorophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate (CAS 1449008-02-9)
- 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1,2,3,4-tetrahydroisoquinoline (CAS 338956-56-2)
- 4-Chloro-3-nitro-N-phenylbenzene-1-sulfonamide (CAS 137-49-5)
- (Z)-5-(4-chloro-3-nitrobenzylidene)-3-ethylthiazolidine-2,4-dione (CAS 685108-31-0)
Recommended Standards
- 6-Chloro-1,1',3,3'-tetramethyl-1H,1'H,2H,2'H,3H,3'H,4H,4'H-[5,5'-bipyrimidine]-2,2',4,4'-tetrone (CAS 860612-47-1)
- 6-((7-Nitrobenzo[c][1,2,5]oxadiazol-4-yl)amino)hexanoyl chloride (CAS 88235-28-3)
- Ethyl 6-(chloromethyl)-4-(4-fluorophenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate (CAS 1260906-12-4)
- 3-[3-(3-chloro-4,5-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]propanoic acid (CAS 937626-14-7)
- 3-(3-Butyn-1-yl)-3H-diazirine-3-propanoic acid (CAS 1450754-37-6)
- (1,4-Difluorocyclohexyl)methanol (CAS 2306271-48-5)
- Amoproxan (CAS 22661-76-3)
- 7-Bromo-2,3,4,5-tetrahydro-1H-benzo[c]azepine (CAS 740842-87-9)
- N-{5,6-dimethyl-1-[(4-methylphenyl)methyl]-1H-1,3-benzodiazol-4-yl}-4-methylbenzene-1-sulfonamide (CAS 338423-17-9)
- 2,5-Dichloro-3-fluorobenzonitrile (CAS 1806355-14-5)
- N-(4-Methoxyphenyl)-3-nitroaniline (CAS 88849-27-8)
- 4-[(4-Aminophenyl)amino]-4-oxobutanoic acid (CAS 5415-22-5)
- Nor-Verapamil D6 HCl (CAS CATO-C4X-177847)
- Semaglutide Impurity 161 (x TFA Salt) (CAS CATO-C4X-2226161)
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