| CAS Number | 73083-41-7 |
| Catalog Number | AG00ICCB(AGN-PC-0WP1TP) |
| Chemical Name | N-Methylbut-3-enamide |
| IUPAC Name | N-methylbut-3-enamide |
| InChI | InChI=1S/C5H9NO/c1-3-4-5(7)6-2/h3H,1,4H2,2H3,(H,6,7) |
| InChI Key | LRSCEVQEEBMAHN-UHFFFAOYSA-N |
| MDL Number | MFCD00020293 |
| Molecular Formula | C5H9NO |
| Molecular Weight | 99.1311 |
| SMILES | CNC(=O)CC=C |
| Synonyms | N-methylbut-3-enamide,
73083-41-7,
ZINC39398539,
AKOS006358390,
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| Complexity | 78.1 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 99.068g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 7 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 99.133g/mol |
| Monoisotopic Mass | 99.068g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 29.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.3 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number