| CAS Number | 1171498-25-1 |
| Catalog Number | AG019LHD(AGN-PC-0WOCA4) |
| Chemical Name | 2-(Pyrrolidin-1-yl)pyridine-3-carbonitrile hydrochloride |
| IUPAC Name | 2-pyrrolidin-1-ylpyridine-3-carbonitrile;hydrochloride |
| InChI | InChI=1S/C10H11N3.ClH/c11-8-9-4-3-5-12-10(9)13-6-1-2-7-13;/h3-5H,1-2,6-7H2;1H |
| InChI Key | AXYQOJLGGLWNSE-UHFFFAOYSA-N |
| MDL Number | MFCD09971440 |
| Molecular Formula | C10H12ClN3 |
| Molecular Weight | 209.6754 |
| SMILES | Cl.N#CC1=C(N2CCCC2)N=CC=C1 |
| Synonyms | 2-(pyrrolidin-1-yl)pyridine-3-carbonitrile hydrochloride,
2-pyrrolidin-1-ylnicotinonitrile hydrochloride,
1171498-25-1,
EN300-31263,
AC1Q3CED,
CTK7C8907,
AKOS026730039,
MCULE-6158605704,
NE14713,
Z324553174,
|
| Complexity | 212 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 209.072g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 209.677g/mol |
| Monoisotopic Mass | 209.072g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 39.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number