| CAS Number | 30486-79-4 |
| Catalog Number | AG01C2XR(AGN-PC-0JTS60) |
| Chemical Name | 5,6-dichloro-1-methyl-1H-1,3-benzodiazol-2-amine |
| IUPAC Name | 5,6-dichloro-1-methylbenzimidazol-2-amine |
| InChI | InChI=1S/C8H7Cl2N3/c1-13-7-3-5(10)4(9)2-6(7)12-8(13)11/h2-3H,1H3,(H2,11,12) |
| InChI Key | ORDJDFMGHFRKJS-UHFFFAOYSA-N |
| MDL Number | MFCD23713845 |
| Molecular Formula | C8H7Cl2N3 |
| Molecular Weight | 216.0673 |
| SMILES | CN1C2=C(C=C(C(=C2)Cl)Cl)N=C1N |
| Synonyms | 30486-79-4,
5,6-dichloro-1-methyl-1H-1,3-benzodiazol-2-amine,
5,6-dichloro-1-methyl-1H-benzoimidazol-2-ylamine,
AC1LD4SE,
2-Amino-5,6-dichloro-1-methylbenzimidazole,
CHEMBL227807,
SCHEMBL2857356,
ORDJDFMGHFRKJS-UHFFFAOYSA-N,
ZINC28640560,
AKOS017269141,
5,6-dichloro-1-methylbenzimidazol-2-amine,
5,6-Dichloro-1-methyl-1H-benzimidazol-2-amine #,
Z57069735,
CID612073,
|
| Complexity | 202 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 215.002g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 216.065g/mol |
| Monoisotopic Mass | 215.002g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 43.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number