| CAS Number | 1255717-15-7 |
| Catalog Number | AG00J1GG |
| Chemical Name | [(1-Isobutyl-1H-imidazol-5-yl)methyl]amine dihydrochloride |
| IUPAC Name | [3-(2-methylpropyl)imidazol-4-yl]methanamine;dihydrochloride |
| InChI | InChI=1S/C8H15N3.2ClH/c1-7(2)5-11-6-10-4-8(11)3-9;;/h4,6-7H,3,5,9H2,1-2H3;2*1H |
| InChI Key | VBKXCEYWEHQXDO-UHFFFAOYSA-N |
| MDL Number | MFCD09864333 |
| Molecular Formula | C8H17Cl2N3 |
| Molecular Weight | 226.1467 |
| SMILES | N1(CC(C)C)C=NC=C1CN.Cl.Cl |
| Synonyms | 1255717-15-7,
[(1-Isobutyl-1H-imidazol-5-yl)methyl]amine dihydrochloride,
(1-Isobutyl-1H-imidazol-5-yl)methanamine dihydrochloride,
ZX-CM004392,
MFCD09864333,
MCULE-9248915033,
4014758-25G,
4014758-50G,
1-(1-Isobutyl-1H-imidazol-5-yl)methanamine dihydrochloride,
1-(1-Isobutyl-1H-imidazol-5-yl)methanamine dihydrochloride, AldrichCPR,
|
| Complexity | 114 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 225.08g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 226.145g/mol |
| Monoisotopic Mass | 225.08g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 43.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number