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Moligand™, ≥99% Moligand™ for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
| Canonical Smiles | C1C(C(OC1N2C=C(C=NC2=O)I)CO)O |
|---|---|
| IUPAC Name | 1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-iodopyrimidin-2-one |
| InChIKey | XIJXHOVKJAXCGJ-XLPZGREQSA-N |
| INCHI | 1S/C9H11IN2O4/c10-5-2-11-9(15)12(3-5)8-1-6(14)7(4-13)16-8/h2-3,6-8,13-14H,1,4H2/t6-,7+,8+/m0/s1 |
| Isomeric SMILES | C1[C@@H]([C@H](O[C@H]1N2C=C(C=NC2=O)I)CO)O |
| Alternate CAS | 93265-81-7 |
| PubChem CID | 9840777 |
| MeSH Entry Terms | 1-(2-deoxy-beta-ribofuranosyl)-5-iodo-2-pyrimidinone;5-iodo-2-pyrimidinone 2' deoxyribonucleoside;5-iodo-2-pyrimidinone-2'-deoxyribose;IPdR;ropidoxuridine |
| Molecular Weight | 338.10 |
Comprehensive hazard, handling, storage, and regulatory compliance document.
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View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Nucleosides, nucleotides, and analogues |
| Class | Pyrimidine nucleosides |
| Subclass | Pyrimidine 2'-deoxyribonucleosides |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Pyrimidine 2'-deoxyribonucleosides |
| Alternative Parents | Pyrimidones Halopyrimidines Hydropyrimidines Aryl iodides Tetrahydrofurans Heteroaromatic compounds Secondary alcohols Oxacyclic compounds Azacyclic compounds Primary alcohols Organopnictogen compounds Organonitrogen compounds Organoiodides Organic oxides Hydrocarbon derivatives |
| Molecular Framework | Aromatic heteromonocyclic compounds |
| Substituents | Pyrimidine 2'-deoxyribonucleoside - Halopyrimidine - Pyrimidone - Aryl halide - Aryl iodide - Hydropyrimidine - Pyrimidine - Heteroaromatic compound - Tetrahydrofuran - Secondary alcohol - Oxacycle - Azacycle - Organoheterocyclic compound - Hydrocarbon derivative - Primary alcohol - Organooxygen compound - Organonitrogen compound - Organoiodide - Organohalogen compound - Organic oxide - Organopnictogen compound - Organic oxygen compound - Alcohol - Organic nitrogen compound - Aromatic heteromonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as pyrimidine 2'-deoxyribonucleosides. These are compounds consisting of a pyrimidine linked to a ribose which lacks a hydroxyl group at position 2. |
| External Descriptors | Not available |
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Date | Item |
|---|---|---|---|
| Certificate of Analysis | Feb 06, 2025 | R650004 | |
| Certificate of Analysis | Feb 06, 2025 | R650004 | |
| Certificate of Analysis | Feb 06, 2025 | R650004 | |
| Certificate of Analysis | Feb 06, 2025 | R650004 | |
| Certificate of Analysis | Feb 06, 2025 | R650004 | |
| Certificate of Analysis | Feb 06, 2025 | R650004 | |
| Certificate of Analysis | Feb 06, 2025 | R650004 | |
| Certificate of Analysis | Feb 06, 2025 | R650004 |
| Solubility | DMSO : 250 mg/mL (739.43 mM; Need ultrasonic) |
|---|---|
| Molecular Weight | 338.100 g/mol |
| XLogP3 | -0.500 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 2 |
| Exact Mass | 337.976 Da |
| Monoisotopic Mass | 337.976 Da |
| Topological Polar Surface Area | 82.400 Ų |
| Heavy Atom Count | 16 |
| Formal Charge | 0 |
| Complexity | 357.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 3 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |
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