| CAS Number | 1156884-70-6 |
| Catalog Number | AG008V4F(AGN-PC-0WB7HZ) |
| Chemical Name | [1-(4-Methyl-1h-imidazol-2-yl)ethyl]amine dihydrochloride |
| IUPAC Name | 1-(5-methyl-1H-imidazol-2-yl)ethanamine |
| InChI | InChI=1S/C6H11N3/c1-4-3-8-6(9-4)5(2)7/h3,5H,7H2,1-2H3,(H,8,9) |
| InChI Key | KLZMGVSSVJMZJW-UHFFFAOYSA-N |
| MDL Number | MFCD12105023 |
| Molecular Formula | C6H11N3 |
| Molecular Weight | 125.1716 |
| SMILES | CC(C1NC(C)=CN=1)N |
| Synonyms | 1156884-70-6,
[1-(4-methyl-1H-imidazol-2-yl)ethyl]amine dihydrochloride,
1-(4-methyl-1H-imidazol-2-yl)ethanamine,
SCHEMBL6259613,
ALBB-028865,
ZX-AN079678,
ZX-CM013775,
AKOS022473987,
AKOS022764490,
Y-7051,
1-(4-methyl-1H-imidazol-2-yl)ethanamine(SALTDATA,
1-(4-Methyl-1H-imidazol-2-yl)ethanamine, AldrichCPR,
1-(4-methyl-1H-imidazol-2-yl)ethanamine dihydrochloride,
|
| Complexity | 94.3 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 125.095g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 125.175g/mol |
| Monoisotopic Mass | 125.095g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 54.7A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number