| CAS Number | 1207175-12-9 |
| Catalog Number | AG009652(AGN-PC-0AM1BD) |
| Chemical Name | 5-Methylpyridazin-3(4H)-one |
| IUPAC Name | 5-methyl-4H-pyridazin-3-one |
| InChI | InChI=1S/C5H6N2O/c1-4-2-5(8)7-6-3-4/h3H,2H2,1H3 |
| InChI Key | UTFJNHLFIUKNCF-UHFFFAOYSA-N |
| MDL Number | MFCD14586348 |
| Molecular Formula | C5H6N2O |
| Molecular Weight | 110.1139 |
| SMILES | CC1=CN=NC(=O)C1 |
| Synonyms | 5-methylpyridazin-3(4H)-one,
1207175-12-9,
DTXSID20717340,
5887AH,
MFCD14586348,
AKOS006335633,
ZINC100229923,
K-1475,
J-004387,
C5H6N2O,
|
| Complexity | 169 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 110.048g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 110.116g/mol |
| Monoisotopic Mass | 110.048g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 41.8A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.4 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number