7-(2-(Diethylamino)ethyl)-1,3-dimethyl-6-thioxo-1,3,6,7-tetrahydro-2H-purin-2-one compound with iodomethane (1:1) CAS 97194-78-0
| CAS No. | 97194-78-0 |
| Molecular Formula | C13H21N5OS |
| Molecular Weight | N/A |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
7-(2-(Diethylamino)ethyl)-1,3-dimethyl-6-thioxo-1,3,6,7-tetrahydro-2H-purin-2-one compound with iodomethane (1:1) (CAS 97194-78-0), molecular formula C13H21N5OSCH3I and molecular weight 437.34 g/mol, is a CATO reference standard with documented purity and traceability.
Structurally, 7-(2-(Diethylamino)ethyl)-1,3-dimethyl-6-thioxo-1,3,6,7-tetrahydro-2H-purin-2-one compound with iodomethane (1:1) (C13H21N5OSCH3I) contains a nitrogen-containing heterocyclic scaffold, an amide group, sulfur-containing functionality, a hydroxyl group, an ether linkage, iodine substitution. The molecule exhibits a degree of unsaturation (DBE) of 5.0, corresponding to approximately 5 ring(s) or double-bond equivalent(s). With a molecular weight of 437.34 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).
This reference standard is suitable for quantitative analysis on major chromatographic platforms including HPLC, GC, LC-MS/MS, and GC-MS, serving as an external calibration standard or a system suitability test reference material.
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 | C13H21N5OS CH3I |
| Molecular Weight | 437.34 g/mol |
| 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) | 5.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1984 |
| Halogen Content | I-containing |
| Nitrogen Atoms | 5 |
| Sulfur Atoms | 1 |
Related Diethylamino Standards
- 2-(Diethylamino)Ethanol (CAS 100-37-8)
- 4-(Diethylamino)benzohydrazide (CAS 100139-54-6)
- 2-(2-((Diethylamino)methyl)piperidin-1-yl)acetic acid (CAS 100158-79-0)
- 3-((Diethylamino)methyl)piperidin-3-ol (CAS 1001754-35-3)
- 4-(4-(Diethylamino)styryl)-N,N-diphenylaniline (CAS 100463-48-7)
- 2-(2-(Diethylamino)ethyl)-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxylic acid (CAS 1005060-07-0)
- 2-((5-(Diethylamino)-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)(hexyl)amino)ethanol (CAS 100557-06-0)
- (R)-2-(DIETHYLAMINO)BUTANOIC ACID (CAS 1007880-53-6)
Recommended Standards
- C8-IDTT-CHO (CAS 2226449-53-0)
- N-((2,5,6-Trichloropyrimidin-4-yl)oxy)benzimidamide (CAS 88660-72-4)
- (S)-tert-butyl 3-(3-chlorobenzoyl)piperidine-1-carboxylate (CAS 1438393-11-3)
- (4-Methylpiperidin-4-yl)methanamine (CAS 1342518-35-7)
- 2-(1-Methylhydrazinyl)-6-(trifluoromethyl)pyridine (CAS 163620-27-7)
- 8-Chloro-7-methylisoquinoline (CAS 61563-29-9)
- N-(3-Hydroxy-3-phenylpropyl)cyclobutanecarboxamide (CAS 1396747-41-3)
- 7-Methoxy-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)quinoline (CAS 1637325-21-3)
- 2-(2-Methylbutyl)-1H-benzo[d]imidazole (CAS 59652-30-1)
- Galanin (1-13)-Neuropeptide Y (25-36) amide (CAS 147138-51-0)
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