| CAS Number | 1360932-45-1 |
| Catalog Number | AG00HUGD(AGN-PC-0WQXHR) |
| Chemical Name | 6-Bromo-4-chloro-1H-benzimidazole |
| IUPAC Name | 6-bromo-4-chloro-1H-benzimidazole |
| InChI | InChI=1S/C7H4BrClN2/c8-4-1-5(9)7-6(2-4)10-3-11-7/h1-3H,(H,10,11) |
| InChI Key | IZEKQLHDUSVAKK-UHFFFAOYSA-N |
| MDL Number | MFCD22378839 |
| Molecular Formula | C7H4BrClN2 |
| Molecular Weight | 231.4771 |
| SMILES | BrC=1C=C(C2=C(NC=N2)C1)Cl |
| Synonyms | 6-Bromo-4-chloro-1H-benzimidazole,
1360932-45-1,
5-bromo-7-chloro-1H-benzimidazole,
SCHEMBL18554387,
ZX-AT013933,
MFCD22378839,
ZINC76938838,
AKOS025136061,
FCH1616144,
OR70112,
5-bromo-7-chloro-1H-benzo[d]imidazole,
PS-11805,
6-BROMO-4-CHLORO-3H-1,3-BENZODIAZOLE,
AS-813/43501535,
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| 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
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Certificate of Analysis
Lot Number