| CAS Number | 1093881-08-3 |
| Catalog Number | AG0096G8 |
| Chemical Name | 2-(6-Chloropyridazin-3-yl)propan-2-ol |
| IUPAC Name | 2-(6-chloropyridazin-3-yl)propan-2-ol |
| InChI | InChI=1S/C7H9ClN2O/c1-7(2,11)5-3-4-6(8)10-9-5/h3-4,11H,1-2H3 |
| InChI Key | XIYLFAZRGGRFKD-UHFFFAOYSA-N |
| MDL Number | MFCD16988471 |
| Molecular Formula | C7H9ClN2O |
| Molecular Weight | 172.6122 |
| SMILES | CC(C1=NN=C(Cl)C=C1)(O)C |
| Synonyms | 2-(6-chloropyridazin-3-yl)propan-2-ol,
1093881-08-3,
SCHEMBL1000276,
XIYLFAZRGGRFKD-UHFFFAOYSA-N,
AKOS032945571,
ZINC115001729,
DA-15643,
2-(6-chloropyridazin-3-yl)-propan-2-ol,
2-(6-Chloro-pyridazin-3-yl)-propan-2-ol,
FT-0724957,
|
| Complexity | 140 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 172.04g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 172.612g/mol |
| Monoisotopic Mass | 172.04g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 46A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number