| CAS Number | 1075260-61-5 |
| Catalog Number | AG01C1RI |
| Chemical Name | 3-Chloro-5H,7H,8H-Pyrano[4,3-C]Pyridazine |
| IUPAC Name | 3-chloro-7,8-dihydro-5H-pyrano[4,3-c]pyridazine |
| InChI | InChI=1S/C7H7ClN2O/c8-7-3-5-4-11-2-1-6(5)9-10-7/h3H,1-2,4H2 |
| InChI Key | UICWLNDRGTYAHW-UHFFFAOYSA-N |
| MDL Number | MFCD16871395 |
| Molecular Formula | C7H7ClN2O |
| Molecular Weight | 170.5963 |
| SMILES | ClC1=NN=C(CCOC2)C2=C1 |
| Synonyms | 3-chloro-5H,7H,8H-pyrano[4,3-c]pyridazine,
1075260-61-5,
3-chloro-7,8-dihydro-5H-pyrano[4,3-c]pyridazine,
SCHEMBL3605741,
UICWLNDRGTYAHW-UHFFFAOYSA-N,
ZINC54930883,
AKOS012079138,
F8883-1703,
|
| Complexity | 144 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 170.025g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 170.596g/mol |
| Monoisotopic Mass | 170.025g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 35A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number