| CAS Number | 59022-78-5 |
| Catalog Number | AG00EL04 |
| Chemical Name | 4-(chloromethyl)-2-methyl-1H-imidazole hydrochloride |
| IUPAC Name | 5-(chloromethyl)-2-methyl-1H-imidazole;hydrochloride |
| InChI | InChI=1S/C5H7ClN2.ClH/c1-4-7-3-5(2-6)8-4;/h3H,2H2,1H3,(H,7,8);1H |
| InChI Key | MUWHKRXEROAPOR-UHFFFAOYSA-N |
| MDL Number | MFCD28891646 |
| Molecular Formula | C5H8Cl2N2 |
| Molecular Weight | 167.0364 |
| SMILES | Cl.CC1NC=C(CCl)N=1 |
| Synonyms | 4-(Chloromethyl)-2-methyl-1H-imidazole hydrochloride,
59022-78-5,
SCHEMBL8114903,
5-ChloroMethyl-2-Methyl-1H-iMidazole,
|
| Complexity | 76.8 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 166.006g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 167.033g/mol |
| Monoisotopic Mass | 166.006g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 28.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
Lot Number