| CAS Number | 1204296-35-4 |
| Catalog Number | AG01AR5M(AGN-PC-0WCNH5) |
| Chemical Name | 6-chloro-3-(methoxymethyl)-[1,2,4]triazolo[4,3-b]pyridazine |
| IUPAC Name | 6-chloro-3-(methoxymethyl)-[1,2,4]triazolo[4,3-b]pyridazine |
| InChI | InChI=1S/C7H7ClN4O/c1-13-4-7-10-9-6-3-2-5(8)11-12(6)7/h2-3H,4H2,1H3 |
| InChI Key | WTJFOKBEZNTZSA-UHFFFAOYSA-N |
| MDL Number | MFCD14611321 |
| Molecular Formula | C7H7ClN4O |
| Molecular Weight | 198.6097 |
| SMILES | COCC1N2C(C=CC(=N2)Cl)=NN=1 |
| Synonyms | 6-chloro-3-(methoxymethyl)[1,2,4]triazolo[4,3-b]pyridazine,
1204296-35-4,
6-chloro-3-(methoxymethyl)-[1,2,4]triazolo[4,3-b]pyridazine,
ALBB-032478,
ZINC38478029,
AKOS010530851,
MCULE-5395914956,
L-3876,
F1967-0572,
N/A,
|
| Complexity | 182 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 198.031g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 198.61g/mol |
| Monoisotopic Mass | 198.031g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 52.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number