| CAS Number | 78316-13-9 |
| Catalog Number | AG00GA2V(AGN-PC-0WALQD) |
| Chemical Name | 3H-imidazo[4,5-b]pyridine-7-carbonitrile |
| IUPAC Name | 1H-imidazo[4,5-b]pyridine-7-carbonitrile |
| InChI | InChI=1S/C7H4N4/c8-3-5-1-2-9-7-6(5)10-4-11-7/h1-2,4H,(H,9,10,11) |
| InChI Key | PSYSLTIGGKLQGF-UHFFFAOYSA-N |
| MDL Number | MFCD05723322 |
| Molecular Formula | C7H4N4 |
| Molecular Weight | 144.1335 |
| SMILES | N#CC1=C2C(NC=N2)=NC=C1 |
| Synonyms | 3H-IMIDAZO[4,5-B]PYRIDINE-7-CARBONITRILE,
78316-13-9,
7-CYANO-3H-IMIDAZO[4,5-B]PYRIDINE,
SCHEMBL3670084,
SCHEMBL18663609,
MFCD05723322,
ZINC44550832,
AKOS025403858,
PB29347,
AS-50474,
1H-imidazo[4,5-b]pyridine-7-carbonitrile,
CS-0051348,
Q-2605,
|
| Complexity | 194 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 144.044g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 144.137g/mol |
| Monoisotopic Mass | 144.044g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 65.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.5 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number