| CAS Number | 1249394-70-4 |
| Catalog Number | AG01AI1P(AGN-PC-0WOB00) |
| Chemical Name | 1-cyano-N,N-dimethylcyclopentane-1-carboxamide |
| IUPAC Name | 1-cyano-N,N-dimethylcyclopentane-1-carboxamide |
| InChI | InChI=1S/C9H14N2O/c1-11(2)8(12)9(7-10)5-3-4-6-9/h3-6H2,1-2H3 |
| InChI Key | AJSJIKWFYMANGM-UHFFFAOYSA-N |
| MDL Number | MFCD16104653 |
| Molecular Formula | C9H14N2O |
| Molecular Weight | 166.2203 |
| SMILES | CN(C(C1(C#N)CCCC1)=O)C |
| Synonyms | 1-cyano-N,N-dimethylcyclopentane-1-carboxamide,
1249394-70-4,
ZINC44292391,
AKOS009041128,
NE41054,
EN300-76476,
|
| Complexity | 230 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 166.111g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 166.224g/mol |
| Monoisotopic Mass | 166.111g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 44.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number