| CAS Number | 16401-71-1 |
| Catalog Number | AG01AGLS(AGN-PC-0LT6M1) |
| Chemical Name | N-methylcinnolin-4-amine |
| IUPAC Name | N-methylcinnolin-4-amine |
| InChI | InChI=1S/C9H9N3/c1-10-9-6-11-12-8-5-3-2-4-7(8)9/h2-6H,1H3,(H,10,12) |
| InChI Key | JQWMWQFXJCCGIH-UHFFFAOYSA-N |
| MDL Number | MFCD00956918 |
| Molecular Formula | C9H9N3 |
| Molecular Weight | 159.1879 |
| SMILES | CNC1=C2C(C=CC=C2)=NN=C1 |
| Synonyms | N-methylcinnolin-4-amine,
16401-71-1,
N-methyl-4-cinnolinamine,
AC1Q40WR,
AC1O4S55,
SCHEMBL18879049,
ZINC5353872,
AKOS012896880,
MCULE-7853778830,
NE42696,
EN300-72217,
AK-830/40406127,
Z1266823173,
Cinnolin-4-yl-methyl-amine,
CID6412705,
|
| Complexity | 149 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 159.08g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 159.192g/mol |
| Monoisotopic Mass | 159.08g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 37.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number