| CAS Number | 123523-58-0 |
| Catalog Number | AG01AMXW(AGN-PC-0NHYNL) |
| Chemical Name | N-(prop-2-yn-1-yl)prop-2-enamide |
| IUPAC Name | N-prop-2-ynylprop-2-enamide |
| InChI | InChI=1S/C6H7NO/c1-3-5-7-6(8)4-2/h1,4H,2,5H2,(H,7,8) |
| InChI Key | YGMMGFRCYBLJST-UHFFFAOYSA-N |
| MDL Number | MFCD12091202 |
| Molecular Formula | C6H7NO |
| Molecular Weight | 109.1259 |
| SMILES | C(C#C)NC(C=C)=O |
| Synonyms | 123523-58-0,
N-(prop-2-yn-1-yl)acrylamide,
n-propargylacrylamide,
N-(prop-2-yn-1-yl)prop-2-enamide,
n-propargyl acrylamide,
SCHEMBL3932329,
2-Propenamide, N-2-propynyl-,
ZINC36334249,
AKOS006039587,
AK00799212,
Z1937760205,
2-Propenamide,N-2-propynyl-,
|
| Complexity | 140 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 109.053g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 109.128g/mol |
| Monoisotopic Mass | 109.053g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 29.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number