| CAS Number | 1052530-04-7 |
| Catalog Number | AG00HALP(AGN-PC-0WBPSS) |
| Chemical Name | 5-Chloro-2-(chloromethyl)-1-methyl-1h-imidazole, HCl |
| IUPAC Name | 5-chloro-2-(chloromethyl)-1-methylimidazole;hydrochloride |
| InChI | InChI=1S/C5H6Cl2N2.ClH/c1-9-4(7)3-8-5(9)2-6;/h3H,2H2,1H3;1H |
| InChI Key | ZOQVIBAKFBPLJT-UHFFFAOYSA-N |
| MDL Number | MFCD06684180 |
| Molecular Formula | C5H7Cl3N2 |
| Molecular Weight | 201.4815 |
| SMILES | Cl.CN1C(CCl)=NC=C1Cl |
| Synonyms | 5-chloro-2-(chloromethyl)-1-methyl-1H-imidazole hydrochloride,
1052530-04-7,
5-CHLORO-2-CHLOROMETHYL-1-METHYL-1H-IMIDAZOLE HYDROCHLORIDE,
AC1Q3BMS,
SCHEMBL859619,
CTK6H6986,
ZOQVIBAKFBPLJT-UHFFFAOYSA-N,
MFCD06684180,
AKOS026676596,
NE21518,
EN300-13361,
C80228,
5-Chloro-2-chloromethyl-1-methyl-1H-imidazole HCl,
F8880-7517,
900640-98-4,
|
| Complexity | 99 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 199.967g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 201.475g/mol |
| Monoisotopic Mass | 199.967g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 17.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number