≥95% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Store at 2-8°C Ships Wet ice 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 1 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
| Pubchem Sid | 504758111 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/504758111 |
| Canonical Smiles | CN(C)C(=O)CC#N |
| IUPAC Name | 2-cyano-N,N-dimethylacetamide |
| InChIKey | MATJPVGBSAQWAC-UHFFFAOYSA-N |
| INCHI | 1S/C5H8N2O/c1-7(2)5(8)3-4-6/h3H2,1-2H3 |
| Isomeric SMILES | CN(C)C(=O)CC#N |
| Molecular Weight | 112.13 |
| Reaxy-Rn | 773950 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=773950&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 acids and derivatives |
| Class | Carboxylic acids and derivatives |
| Subclass | Carboxylic acid derivatives |
| Intermediate Tree Nodes | Carboxylic acid amides |
| Direct Parent | Tertiary carboxylic acid amides |
| Alternative Parents | Nitriles Organopnictogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds |
| Molecular Framework | Aliphatic acyclic compounds |
| Substituents | Tertiary carboxylic acid amide - Nitrile - Carbonitrile - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Carbonyl group - Aliphatic acyclic compound |
| Description | This compound belongs to the class of organic compounds known as tertiary carboxylic acid amides. These are compounds containing an amide derivative of carboxylic acid, with the general structure RN(R1)C(R2)=O (R1-R2 any atom but H). |
| 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 |
|---|---|---|---|
 C2625017 | Certificate of Analysis | Apr 01, 2026 | C135281 |
| B23211013 | Certificate of Analysis | Dec 19, 2024 | C135281 |
| B23211039 | Certificate of Analysis | Dec 19, 2024 | C135281 |
| B23211064 | Certificate of Analysis | Dec 19, 2024 | C135281 |
| B2321857 | Certificate of Analysis | Dec 19, 2024 | C135281 |
| Solubility | Soluble in Methanol |
|---|---|
| Melt Point(°C) | 66°C(lit.) |
| Molecular Weight | 112.130 g/mol |
| XLogP3 | -0.400 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 1 |
| Exact Mass | 112.064 Da |
| Monoisotopic Mass | 112.064 Da |
| Topological Polar Surface Area | 44.100 Ų |
| Heavy Atom Count | 8 |
| Formal Charge | 0 |
| Complexity | 131.000 |
| 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 |
| 1. Yuxin Xue, Qiong Lin, Xiangfeng Sun, Dongxia Li, Yulin Fu, Zhiqi Li, Yuanhao Shi, Chongxian Luo, Xuefeng Gui, Kai Xu. (2025) 3D Silsesquioxane Cage-Based Covalent Organic Frameworks Enabling Efficient Ion Transport in Quasi-Solid-State Lithium Metal Batteries. Small, [PMID:40237118] [10.1002/smll.202501988] |
