| CAS Number | 1312440-90-6 |
| Catalog Number | AG009ED5(AGN-PC-0WABSN) |
| Chemical Name | 3H-IMidazo[4,5-c]pyridine, 6-broMo- |
| IUPAC Name | 6-bromo-3H-imidazo[4,5-c]pyridine |
| InChI | InChI=1S/C6H4BrN3/c7-6-1-4-5(2-8-6)10-3-9-4/h1-3H,(H,9,10) |
| InChI Key | PIOVHWCIWRDULB-UHFFFAOYSA-N |
| MDL Number | MFCD19288874 |
| Molecular Formula | C6H4BrN3 |
| Molecular Weight | 198.0201 |
| SMILES | C1=C2C(=CN=C1Br)NC=N2 |
| Synonyms | 6-bromo-1H-imidazo[4,5-c]pyridine,
1312440-90-6,
6-bromo-3H-imidazo[4,5-c]pyridine,
6-Bromo-5-azabenzimidazole,
SCHEMBL12985527,
DTXSID90732545,
ZX-AT001994,
MFCD19288874,
ZINC66322780,
AKOS024071584,
FCH1133298,
OR46517,
SB10454,
C-0628,
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| Complexity | 130 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 196.959g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 198.023g/mol |
| Monoisotopic Mass | 196.959g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 41.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number