| CAS Number | 872292-64-3 |
| Catalog Number | AG01A7Z5 |
| Chemical Name | 3-Chloro-5H,6H,7H-cyclopenta[c]pyridazine |
| IUPAC Name | 3-chloro-6,7-dihydro-5H-cyclopenta[c]pyridazine |
| InChI | InChI=1S/C7H7ClN2/c8-7-4-5-2-1-3-6(5)9-10-7/h4H,1-3H2 |
| InChI Key | UCOMGQRYTLYYGM-UHFFFAOYSA-N |
| MDL Number | MFCD16683700 |
| Molecular Formula | C7H7ClN2 |
| Molecular Weight | 154.5969 |
| SMILES | Clc1nnc2c(c1)CCC2 |
| Synonyms | 3-chloro-5H,6H,7H-cyclopenta[c]pyridazine,
872292-64-3,
3-chloro-6,7-dihydro-5H-cyclopenta[c]pyridazine,
SCHEMBL3618044,
DTXSID10648038,
TPC-011,
ZINC50266227,
AKOS011342004,
NE21688,
3-Chloro-6,7-dihydro-cyclopenta[c]pyridazine,
F8880-1480,
|
| Complexity | 129 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 154.03g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 154.597g/mol |
| Monoisotopic Mass | 154.03g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 25.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number