| CAS Number | 1158508-31-6 |
| Catalog Number | AG00J1ZP(AGN-PC-0WBU51) |
| Chemical Name | 1-(5-Amino-1-methyl-1H-benzimidazol-2-yl)ethanol dihydrochloride |
| IUPAC Name | 1-(5-amino-1-methylbenzimidazol-2-yl)ethanol;dihydrochloride |
| InChI | InChI=1S/C10H13N3O.2ClH/c1-6(14)10-12-8-5-7(11)3-4-9(8)13(10)2;;/h3-6,14H,11H2,1-2H3;2*1H |
| InChI Key | YRPFNOYHACWFTH-UHFFFAOYSA-N |
| MDL Number | MFCD03872212 |
| Molecular Formula | C10H15Cl2N3O |
| Molecular Weight | 264.1516 |
| SMILES | Nc1ccc2c(c1)nc(n2C)C(O)C.Cl.Cl |
| Synonyms | 1-(5-amino-1-methyl-1h-benzimidazol-2-yl)ethanol dihydrochloride,
799260-16-5,
1-(5-Amino-1-methyl-1H-benzoimidazol-2-yl)-ethanol dihydrochloride,
1158508-31-6,
CTK7D8531,
DTXSID20661319,
ZX-CM007255,
MFCD03872212,
AKOS015845146,
MCULE-8381476850,
TR-042628,
1-(5-amino-1-methyl-1,3-benzodiazol-2-yl)ethanol dihydrochloride,
1-(5-Amino-1-methyl-1H-benzoimidazol-2-yl)-ethanoldihydrochloride,
1-(5-amino-1-methyl-1 h-benzoimidazol-2-yl)-ethanol dihydrochloride,
1-(5-Amino-1-methyl-1H-benzo[d]imidazol-2-yl)ethanol dihydrochloride,
1-(5-Amino-1-methyl-1H-benzoimidazol-2-yl)-ethanol di hydrochloride,
1-(5-amino-1-methyl-1h-benzoimidazol-2-yl)-ethanol, dihydrochloride,
1-(5-Amino-1-methyl-1H-benzimidazol-2-yl)ethan-1-ol--hydrogen chloride (1/2),
|
| Complexity | 212 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 263.059g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 4 |
| Isotope Atom Count | 0 |
| Molecular Weight | 264.15g/mol |
| Monoisotopic Mass | 263.059g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 64.1A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number