| CAS Number | 1367799-39-0 |
| Catalog Number | AG01B2C9 |
| Chemical Name | 3-bromo-1-methyl-1H-pyrrolo[3,2-c]pyridine |
| IUPAC Name | 3-bromo-1-methylpyrrolo[3,2-c]pyridine |
| InChI | InChI=1S/C8H7BrN2/c1-11-5-7(9)6-4-10-3-2-8(6)11/h2-5H,1H3 |
| InChI Key | OPNFWGXOYCVWII-UHFFFAOYSA-N |
| MDL Number | MFCD22039256 |
| Molecular Formula | C8H7BrN2 |
| Molecular Weight | 211.0586 |
| SMILES | CN1C2=C(C=NC=C2)C(Br)=C1 |
| Synonyms | 3-bromo-1-methyl-1H-pyrrolo[3,2-c]pyridine,
1367799-39-0,
ZINC82373787,
AKOS022691233,
|
| Complexity | 151 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 209.979g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 211.062g/mol |
| Monoisotopic Mass | 209.979g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 17.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.6 |
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Certificate of Analysis
Lot Number