| CAS Number | 60148-10-9 |
| Catalog Number | AG018S9N(AGN-PC-0NCGYY) |
| Chemical Name | 2-Methyl-1-(pyridin-4-yl)propan-1-one |
| IUPAC Name | 2-methyl-1-pyridin-4-ylpropan-1-one |
| InChI | InChI=1S/C9H11NO/c1-7(2)9(11)8-3-5-10-6-4-8/h3-7H,1-2H3 |
| InChI Key | REQREMPZQWXKAO-UHFFFAOYSA-N |
| MDL Number | MFCD12153290 |
| Molecular Formula | C9H11NO |
| Molecular Weight | 149.1897 |
| SMILES | CC(C(C1=CC=NC=C1)=O)C |
| Synonyms | 2-methyl-1-(pyridin-4-yl)propan-1-one,
60148-10-9,
2-methyl-1-pyridin-4-yl-propan-1-one,
4-Isobutyrylpyridine,
SCHEMBL888683,
REQREMPZQWXKAO-UHFFFAOYSA-N,
ZINC37464022,
AKOS010014805,
NE62670,
EN300-77660,
F8889-3198,
Z2235681155,
CID10898858,
|
| Complexity | 137 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 149.084g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 149.193g/mol |
| Monoisotopic Mass | 149.084g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 30A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number