| CAS Number | 1360953-55-4 |
| Catalog Number | AG00A0OS |
| Chemical Name | 6-Bromo-5-chloro-1H-benzo[d]imidazole |
| IUPAC Name | 5-bromo-6-chloro-1H-benzimidazole |
| InChI | InChI=1S/C7H4BrClN2/c8-4-1-6-7(2-5(4)9)11-3-10-6/h1-3H,(H,10,11) |
| InChI Key | UZPKKTKUNKNWBS-UHFFFAOYSA-N |
| MDL Number | MFCD28154806 |
| Molecular Formula | C7H4BrClN2 |
| Molecular Weight | 231.4771 |
| SMILES | ClC1=C(Br)C=C2C(N=CN2)=C1 |
| Synonyms | 1360953-55-4,
6-Bromo-5-chloro-1H-benzo[d]imidazole,
1H-Benzimidazole, 6-bromo-5-chloro-,
SCHEMBL14722647,
UZPKKTKUNKNWBS-UHFFFAOYSA-N,
6-Bromo-5-chloro-1H-benzimidazole,
ZINC60195698,
AKOS027427415,
AKOS034833034,
5-bromo-6-chloro-1H-benzo[d]imidazole,
5-bromo-6-chloro-1H-1,3-benzodiazole,
|
| Complexity | 155 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 229.925g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 231.477g/mol |
| Monoisotopic Mass | 229.925g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 28.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number