| CAS Number | 75007-86-2 |
| Catalog Number | AG005EZD(AGN-PC-0JPJIC) |
| Chemical Name | 2-(4-Bromophenyl)-3H-imidazo[4,5-b]pyridine |
| IUPAC Name | 2-(4-bromophenyl)-1H-imidazo[4,5-b]pyridine |
| InChI | InChI=1S/C12H8BrN3/c13-9-5-3-8(4-6-9)11-15-10-2-1-7-14-12(10)16-11/h1-7H,(H,14,15,16) |
| InChI Key | VSESNXXKQZZRMB-UHFFFAOYSA-N |
| MDL Number | MFCD09263951 |
| Molecular Formula | C12H8BrN3 |
| Molecular Weight | 274.1160 |
| SMILES | BrC1=CC=C(C=C1)C1=NC=2C(=NC=CC2)N1 |
| Synonyms | 75007-86-2,
2-(4-Bromophenyl)-1H-imidazo(4,5-b)pyridine,
1H-Imidazo(4,5-b)pyridine, 2-(4-bromophenyl)-,
2-(4-bromophenyl)-1H-imidazo[4,5-b]pyridine,
2-(4-bromophenyl)-3H-imidazo[4,5-b]pyridine,
3H-Imidazo[4,5-b]pyridine,2-(4-bromophenyl)-,
AC1L4APR,
CTK5E0906,
DTXSID80225976,
ZINC5117292,
AKOS011054739,
Z1527364936,
2- -1H-imidazo pyridine,
CID153609,
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| Complexity | 240 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 272.99g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 274.121g/mol |
| Monoisotopic Mass | 272.99g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 41.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.3 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
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