| CAS Number | 1187385-67-6 |
| Catalog Number | AG0080Z2(AGN-PC-0WAB33) |
| Chemical Name | 5-Bromo-1-Tert-Butyl-6-Fluorobenzoimidazole |
| IUPAC Name | 5-bromo-1-tert-butyl-6-fluorobenzimidazole |
| InChI | InChI=1S/C11H12BrFN2/c1-11(2,3)15-6-14-9-4-7(12)8(13)5-10(9)15/h4-6H,1-3H3 |
| InChI Key | VZUNNTOJJDXTFK-UHFFFAOYSA-N |
| MDL Number | MFCD12546528 |
| Molecular Formula | C11H12BrFN2 |
| Molecular Weight | 271.1288 |
| SMILES | Brc1cc2ncn(c2cc1F)C(C)(C)C |
| Synonyms | 1187385-67-6,
5-Bromo-1-(tert-butyl)-6-fluoro-1H-benzo[d]imidazole,
5-BROMO-1-TERT-BUTYL-6-FLUOROBENZOIMIDAZOLE,
ACMC-2099ya,
CTK4B0818,
DTXSID70675204,
ANW-17168,
MFCD12546528,
ZINC38537776,
AKOS015835902,
AJ-96227,
AX8230748,
TR-034235,
ST24023853,
Z7950,
A-5257,
5-Bromo-1-tert-butyl-6-fluoro-1H-benzimidazole,
I01-11227,
C11H12BrFN2,
|
| Complexity | 241 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 270.017g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 271.133g/mol |
| Monoisotopic Mass | 270.017g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 17.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.1 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number