| CAS Number | 1936160-39-2 |
| Catalog Number | AG01DW4F |
| Chemical Name | 6-iodopyridazine-3-carbonitrile |
| IUPAC Name | 6-iodopyridazine-3-carbonitrile |
| InChI | InChI=1S/C5H2IN3/c6-5-2-1-4(3-7)8-9-5/h1-2H |
| InChI Key | DWUPXEHNMXIMND-UHFFFAOYSA-N |
| MDL Number | MFCD31559775 |
| Molecular Formula | C5H2IN3 |
| Molecular Weight | 230.9939 |
| SMILES | IC1=NN=C(C#N)C=C1 |
| Synonyms | 6-iodopyridazine-3-carbonitrile,
1936160-39-2,
SCHEMBL14185273,
|
| Complexity | 138 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 230.929g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 230.996g/mol |
| Monoisotopic Mass | 230.929g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 49.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number