| CAS Number | 1036555-53-9 |
| Catalog Number | AG01AHQR |
| Chemical Name | 6-chloro-N-(1-phenylethyl)pyridazin-3-amine |
| IUPAC Name | 6-chloro-N-(1-phenylethyl)pyridazin-3-amine |
| InChI | InChI=1S/C12H12ClN3/c1-9(10-5-3-2-4-6-10)14-12-8-7-11(13)15-16-12/h2-9H,1H3,(H,14,16) |
| InChI Key | YTFBVSPYKWRCPP-UHFFFAOYSA-N |
| MDL Number | MFCD11118868 |
| Molecular Formula | C12H12ClN3 |
| Molecular Weight | 233.6968 |
| SMILES | CC(C1=CC=CC=C1)NC1=NN=C(Cl)C=C1 |
| Synonyms | 6-chloro-N-(1-phenylethyl)pyridazin-3-amine,
1036555-53-9,
AKOS009038533,
MCULE-6008221654,
NE49426,
EN300-75511,
F1967-1249,
Z108584150,
|
| Complexity | 206 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 233.072g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 233.699g/mol |
| Monoisotopic Mass | 233.072g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 37.8A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number