| Pubchem Sid | 504756424 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/504756424 |
| Sonrisas canónicas | C1CC(C(=O)C1)C#N |
| IUPAC Name | 2-oxocyclopentane-1-carbonitrile |
| InChIKey | IPMQSLPLJDKUPI-UHFFFAOYSA-N |
| INCHI | 1S/C6H7NO/c7-4-5-2-1-3-6(5)8/h5H,1-3H2 |
| Isómeros SMILES | C1CC(C(=O)C1)C#N |
| Peso molecular | 109.1 |
| Reaxy-Rn | 907112 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=907112&ln= |
Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS →Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA →Full quality attributes and acceptance criteria for this grade.
View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Organic oxygen compounds |
| Clase | Organooxygen compounds |
| Subclass | Carbonyl compounds |
| Intermediate Tree Nodes | Ketones |
| Direct Parent | Cyclic ketones |
| Alternative Parents | Nitriles Organopnictogen compounds Organic oxides Hydrocarbon derivatives |
| Molecular Framework | Aliphatic homomonocyclic compounds |
| Substituents | Cyclic ketone - Nitrile - Carbonitrile - Organic nitrogen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Aliphatic homomonocyclic compound |
| Descripción | This compound belongs to the class of organic compounds known as cyclic ketones. These are organic compounds containing a ketone that is conjugated to a cyclic moiety. |
| External Descriptors | Not available |
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Fecha | Articulo |
|---|---|---|---|
 L2208607 | Certificate of Analysis | Sep 09, 2025 | C183485 |
| L2207328 | Certificate of Analysis | Sep 09, 2025 | C183485 |
| I1906065 | Certificate of Analysis | Apr 09, 2025 | C183485 |
| L2417207 | Certificate of Analysis | Dec 23, 2024 | C183485 |
| Peso molecular | 109.130 g/mol |
|---|---|
| XLogP3 | 0.400 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 0 |
| Exact Mass | 109.053 Da |
| Monoisotopic Mass | 109.053 Da |
| Topological Polar Surface Area | 40.900 Ų |
| Heavy Atom Count | 8 |
| Formal Charge | 0 |
| Complexity | 153.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |
