| CAS Number | 1185397-76-5 |
| Catalog Number | AG00J12B(AGN-PC-0WB687) |
| Chemical Name | 4-Methyl-2-(2-pyrrolidinyl)-1h-benzimidazole hydrochloride |
| IUPAC Name | 4-methyl-2-pyrrolidin-2-yl-1H-benzimidazole;hydrochloride |
| InChI | InChI=1S/C12H15N3.ClH/c1-8-4-2-5-9-11(8)15-12(14-9)10-6-3-7-13-10;/h2,4-5,10,13H,3,6-7H2,1H3,(H,14,15);1H |
| InChI Key | LDWIVAPXQXSYFT-UHFFFAOYSA-N |
| MDL Number | MFCD13031902 |
| Molecular Formula | C12H16ClN3 |
| Molecular Weight | 237.7285 |
| SMILES | N1C2=C(C)C=CC=C2NC=1C1CCCN1.Cl |
| Synonyms | 1185397-76-5,
4-methyl-2-(2-pyrrolidinyl)-1h-benzimidazole hydrochloride,
4-Methyl-2-(pyrrolidin-2-yl)-1H-benzo[d]imidazole hydrochloride,
ZX-CM002653,
AKOS027426099,
|
| Complexity | 231 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 237.103275g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 237.73g/mol |
| Monoisotopic Mass | 237.103275g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 40.7Ų |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number