| CAS Number | 1158349-65-5 |
| Catalog Number | AG00J150(AGN-PC-0WBCTX) |
| Chemical Name | [(5-chloro-1H-benzimidazol-2-yl)methyl]methylamine dihydrochloride |
| IUPAC Name | 1-(6-chloro-1H-benzimidazol-2-yl)-N-methylmethanamine;dihydrochloride |
| InChI | InChI=1S/C9H10ClN3.2ClH/c1-11-5-9-12-7-3-2-6(10)4-8(7)13-9;;/h2-4,11H,5H2,1H3,(H,12,13);2*1H |
| InChI Key | TZOUCLGPEQYNTG-UHFFFAOYSA-N |
| MDL Number | MFCD11696363 |
| Molecular Formula | C9H12Cl3N3 |
| Molecular Weight | 268.5707 |
| SMILES | N1C2=CC(Cl)=CC=C2NC=1CNC.Cl.Cl |
| Synonyms | 1158349-65-5,
[(5-Chloro-1H-benzimidazol-2-yl)methyl]methylamine dihydrochloride,
N-[(5-chloro-1H-benzimidazol-2-yl)methyl]-N-methylamine dihydrochloride,
ZX-CM002943,
MFCD11696363,
AKOS030246346,
4004789-25G,
4004789-50G,
4004789-100G,
(5-chloro-1h-benzimidazol-2-yl)methylmethylamine dihydrochloride,
[(5-Chloro-1H-benzimidazol-2-yl)methyl]methylamine dihydrochloride, AldrichCPR,
175530-30-0,
|
| Complexity | 176 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 267.01g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 4 |
| Isotope Atom Count | 0 |
| Molecular Weight | 268.566g/mol |
| Monoisotopic Mass | 267.01g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 40.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number