| CAS Number | 1332530-78-5 |
| Catalog Number | AG00J3D1(AGN-PC-0WRAUO) |
| Chemical Name | (5-methyl-1H-imidazol-4-yl)methanamine hydrochloride |
| IUPAC Name | (5-methyl-1H-imidazol-4-yl)methanamine;hydrochloride |
| InChI | InChI=1S/C5H9N3.ClH/c1-4-5(2-6)8-3-7-4;/h3H,2,6H2,1H3,(H,7,8);1H |
| InChI Key | SCCMRVHPEOBFBD-UHFFFAOYSA-N |
| MDL Number | MFCD19103393 |
| Molecular Formula | C5H10ClN3 |
| Molecular Weight | 147.6060 |
| SMILES | Cl.CC1=C(CN)N=CN1 |
| Synonyms | 1332530-78-5,
(4-Methyl-1H-imidazol-5-yl)methanamine hydrochloride,
[(4-METHYL-1H-IMIDAZOL-5-YL)METHYL]AMINE HYDROCHLORIDE,
1-(4-Methyl-1H-imidazol-5-yl)methanamine hydrochloride,
ZX-CM014445,
MFCD19103393,
AKOS032963016,
(5-methyl-3H-imidazol-4-yl)methanamine hydrochloride,
1-(4-Methyl-1H-imidazol-5-yl)methanamine hydrochloride, AldrichCPR,
66780-83-4,
|
| Complexity | 74.1 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 147.056g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 147.606g/mol |
| Monoisotopic Mass | 147.056g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 54.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number