| CAS Number | 1126824-09-6 |
| Catalog Number | AG00HCF4(AGN-PC-0WR4LQ) |
| Chemical Name | 7-bromo-5-methyl-1H-Benzimidazole |
| IUPAC Name | 4-bromo-6-methyl-1H-benzimidazole |
| InChI | InChI=1S/C8H7BrN2/c1-5-2-6(9)8-7(3-5)10-4-11-8/h2-4H,1H3,(H,10,11) |
| InChI Key | QIFKZWBUTNDYFB-UHFFFAOYSA-N |
| MDL Number | MFCD19373989 |
| Molecular Formula | C8H7BrN2 |
| Molecular Weight | 211.0586 |
| SMILES | CC1=CC(Br)=C2C(N=CN2)=C1 |
| Synonyms | 1126824-09-6,
4-Bromo-6-methyl-3H-1,3-benzodiazole,
1H-Benzimidazole, 7-bromo-5-methyl-,
SCHEMBL20385466,
4-Bromo-6-methyl-1H-benzoimidazole,
ZINC62152742,
AKOS022421192,
DB-095648,
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| Complexity | 151 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 209.97926g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 211.06g/mol |
| Monoisotopic Mass | 209.97926g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 28.7Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.5 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number