1-[(2-hydroxyethoxy)methyl]-5-methyl-6-(phenylthio)2,4(1H, 3H)-pyrimidinedione CAS 123027-56-5
| CAS No. | 123027-56-5 |
| Molecular Formula | C14H16N2O4S |
| Molecular Weight | 308.35 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
The occurrence of 1-[(2-hydroxyethoxy)methyl]-5-methyl-6-(phenylthio)2,4(1H, 3H)-pyrimidinedione is closely related to a nitrogen-containing heterocyclic scaffold, an amide group, a sulfone group, a hydroxyl group, an ether linkage in its molecular formula, which determines its behaviour during synthesis, purification, or degradation.
CATO supplies 1-[(2-hydroxyethoxy)methyl]-5-methyl-6-(phenylthio)2,4(1H, 3H)-pyrimidinedione (CAS 123027-56-5), a certified reference material (molecular formula C14H16N2O4S, MW 308.35 g/mol) for analytical method development and quality control.
Structurally, 1-[(2-hydroxyethoxy)methyl]-5-methyl-6-(phenylthio)2,4(1H, 3H)-pyrimidinedione (C14H16N2O4S) contains a nitrogen-containing heterocyclic scaffold, an amide group, a sulfone group, a hydroxyl group, an ether linkage. The molecule exhibits a degree of unsaturation (DBE) of 8.0, corresponding to approximately 8 ring(s) or double-bond equivalent(s). With a molecular weight of 308.35 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.
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 | C14H16N2O4S |
| Molecular Weight | 308.35 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.) | 1992 |
| Nitrogen Atoms | 2 |
| Sulfur Atoms | 1 |
Related hydroxyethoxy Standards
- N2-(2-(2-Hydroxyethoxy)ethyl)-N4-(p-tolyl)-L-asparagine (CAS 1048005-82-8)
- 1-((2-Hydroxyethoxy)methyl)-6-(phenylthio)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one (CAS 125057-06-9)
- 2-(2-(2-Hydroxyethoxy)ethoxy)ethyl benzoate (CAS 23022-51-7)
- 1-((2-Hydroxyethoxy)methyl)-5-iodopyrimidine-2,4(1H,3H)-dione (CAS 78692-74-7)
- Methyl 2-[4-(2-hydroxyethoxy)phenyl]-1H-benzimidazole-5-carboxylate (CAS 1705074-81-2)
- 2-[2-(2-Hydroxyethoxy)ethoxy]ethyl 4-Methylbenzenesulfonate (CAS 77544-68-4)
- N-(9-((2-Hydroxyethoxy)methyl)-9H-purin-6-yl)benzamide (CAS 72710-11-3)
- N2-(2-(2-Hydroxyethoxy)ethyl)-N4-(pyridin-3-yl)-L-asparagine (CAS 1047666-69-2)
Recommended Standards
- 5,5-Diphenylimidazo[2,1-b]thiazole-3,6(2H,5H)-dione (CAS 122180-36-3)
- 2-(4-Methoxyphenyl)benzo[d]imidazo[2,1-b]thiazole-3-carbaldehyde (CAS 127204-73-3)
- 3-({[4-(propan-2-yl)benzene]sulfonyl}methyl)furan-2-carboxylic acid (CAS 1094269-20-1)
- (S)-tert-Butyl 1-(3-fluorobenzoyl)pyrrolidin-3-ylcarbamate (CAS 1286207-75-7)
- 3-[[3,5-Bis(trifluoromethyl)phenyl]amino]-4-[[(2S)-2-pyrrolidinylmethyl]amino]-3-cyclobutene-1,2-dione (CAS 1356935-80-2)
- imidazo[1,2-a]pyrazine-6-carbonitrile (CAS 1276056-81-5)
- 2-Butenedioic acid (2Z)-, polymer with ethenylbenzene, compd. with 2-amino-2-methyl-1-propanol (CAS 143348-13-4)
- 6-Hydroxy-6-(2-nitrophenyl)hexanoic Acid (CAS 198065-04-2)
- 3-Chloro-1-ethyl-4-((3-iodo-1-methyl-1H-pyrazol-4-yl)methyl)-1H-pyrazole (CAS 2739869-33-9)
- Epalrestat-d5 (CAS CATO-CCAD303149)
- N-(5-bromopyridin-2-yl)thiazol-2-amine (CAS 350511-12-5)
- 1-Methylisoquinoline-8-carbaldehyde (CAS 1416713-00-2)
- 1-((Benzylthio)methyl)-1H-benzo[d][1,2,3]triazole (CAS 111198-04-0)
- Gly-Neuroendocrine Regulatory Peptide-3 (human, mouse, rat) trifluoroacetate salt (CAS 1815618-19-9)
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