| CAS Number | 1526403-62-2 |
| Catalog Number | AG01BFOB(AGN-PC-0WOV3Y) |
| Chemical Name | 3-Bromo-5,6-dimethylpyridazine-4-carbonitrile |
| IUPAC Name | 3-bromo-5,6-dimethylpyridazine-4-carbonitrile |
| InChI | InChI=1S/C7H6BrN3/c1-4-5(2)10-11-7(8)6(4)3-9/h1-2H3 |
| InChI Key | SGSZPSPKDRQWII-UHFFFAOYSA-N |
| MDL Number | MFCD23923404 |
| Molecular Formula | C7H6BrN3 |
| Molecular Weight | 212.0466 |
| SMILES | CC1=C(C)C(C#N)=C(Br)N=N1 |
| Synonyms | 3-bromo-5,6-dimethylpyridazine-4-carbonitrile,
1526403-62-2,
ZINC87615432,
AKOS019079119,
FCH4931232,
BBV-43557416,
EN300-187793,
|
| Complexity | 185 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 210.975g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 212.05g/mol |
| Monoisotopic Mass | 210.975g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 49.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
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Certificate of Analysis
Lot Number