≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Room temperature Ships Check lot-specific COA for exact specifications.
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.
Description
Acetylmalononitrile is a malonitrile derivative and its rate accelerating effect on 2,2,6,6-tetramethylpiperidinyloxy (TEMPO)-mediated living free radical polymerization (LFRP) is reported.
| Pubchem Sid | 504762568 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/504762568 |
| Sourires canoniques | CC(=O)C(C#N)C#N |
| IUPAC Name | 2-acetylpropanedinitrile |
| InChIKey | FGRLXMNNTHBYKL-UHFFFAOYSA-N |
| INCHI | 1S/C5H4N2O/c1-4(8)5(2-6)3-7/h5H,1H3 |
| Isomères SMILES | CC(=O)C(C#N)C#N |
| Poids moléculaire | 108.1 |
| Reaxy-Rn | 1748631 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1748631&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 |
| Classe | Organooxygen compounds |
| Subclass | Carbonyl compounds |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Ketones |
| Alternative Parents | Nitriles Organic oxides Hydrocarbon derivatives |
| Molecular Framework | Aliphatic acyclic compounds |
| Substituents | Ketone - Nitrile - Carbonitrile - Organic nitrogen compound - Cyanide - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Aliphatic acyclic compound |
| Description | This compound belongs to the class of organic compounds known as ketones. These are organic compounds in which a carbonyl group is bonded to two carbon atoms R2C=O (neither R may be a hydrogen atom). Ketones that have one or more alpha-hydrogen atoms undergo keto-enol tautomerization, the tautomer being an enol. |
| 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 | Article |
|---|---|---|---|
 A2404105 | Certificate of Analysis | Nov 24, 2023 | A472216 |
| A2404106 | Certificate of Analysis | Nov 24, 2023 | A472216 |
| A2404107 | Certificate of Analysis | Nov 24, 2023 | A472216 |
| A2404108 | Certificate of Analysis | Nov 24, 2023 | A472216 |
| A2404487 | Certificate of Analysis | Nov 24, 2023 | A472216 |
| A2404497 | Certificate of Analysis | Nov 24, 2023 | A472216 |
| Point de fusion (°C) | 138-141° C (lit.) |
|---|---|
| Poids moléculaire | 108.100 g/mol |
| XLogP3 | -0.200 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 1 |
| Exact Mass | 108.032 Da |
| Monoisotopic Mass | 108.032 Da |
| Topological Polar Surface Area | 64.700 Ų |
| Heavy Atom Count | 8 |
| Formal Charge | 0 |
| Complexity | 173.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| 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 |
