| CAS Number | 922178-99-2 |
| Catalog Number | AG006F4U(AGN-PC-04PK2K) |
| Chemical Name | 2-cyano-N-ethyl-N-phenylacetamide |
| IUPAC Name | 2-cyano-N-ethyl-N-phenylacetamide |
| InChI | InChI=1S/C11H12N2O/c1-2-13(11(14)8-9-12)10-6-4-3-5-7-10/h3-7H,2,8H2,1H3 |
| InChI Key | AXNPGHABYNZUBL-UHFFFAOYSA-N |
| MDL Number | MFCD09938464 |
| Molecular Formula | C11H12N2O |
| Molecular Weight | 188.2258 |
| SMILES | CCN(C1=CC=CC=C1)C(CC#N)=O |
| Synonyms | 2-cyano-N-ethyl-N-phenylacetamide,
922178-99-2,
Acetamide, 2-cyano-N-ethyl-N-phenyl-,
cyanoacetic ethylphenylamide,
SCHEMBL11647636,
CTK3H0551,
DTXSID50640834,
ZINC19478024,
AKOS000181354,
NE17610,
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| Complexity | 235 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 188.095g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 188.23g/mol |
| Monoisotopic Mass | 188.095g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 44.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.5 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number