| CAS Number | 1428532-82-4 |
| Catalog Number | AG00HWPI(AGN-PC-0WQX27) |
| Chemical Name | 3,6-Dimethoxy-4-hydroxypyridazine |
| IUPAC Name | 3,6-dimethoxy-1H-pyridazin-4-one |
| InChI | InChI=1S/C6H8N2O3/c1-10-5-3-4(9)6(11-2)8-7-5/h3H,1-2H3,(H,7,9) |
| InChI Key | OPLWHAPNMJIUSQ-UHFFFAOYSA-N |
| MDL Number | MFCD23701100 |
| Molecular Formula | C6H8N2O3 |
| Molecular Weight | 156.1393 |
| SMILES | COc1nnc(c(c1)O)OC |
| Synonyms | 3,6-Dimethoxy-4-hydroxypyridazine,
1428532-82-4,
3,6-Dimethoxypyridazin-4-ol,
ZINC95616386,
C-0285,
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| Complexity | 232 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 156.053g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 156.141g/mol |
| Monoisotopic Mass | 156.053g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 59.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.4 |
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Certificate of Analysis
Lot Number