| CAS Number | 1210227-31-8 |
| Catalog Number | AG019WP8(AGN-PC-0WO98L) |
| Chemical Name | 4-bromo-1H-pyrrolo[2,3-b]pyridine-3-sulfonyl chloride |
| IUPAC Name | 4-bromo-1H-pyrrolo[2,3-b]pyridine-3-sulfonyl chloride |
| InChI | InChI=1S/C7H4BrClN2O2S/c8-4-1-2-10-7-6(4)5(3-11-7)14(9,12)13/h1-3H,(H,10,11) |
| InChI Key | WAAMDGXSQBWXPC-UHFFFAOYSA-N |
| MDL Number | MFCD12913150 |
| Molecular Formula | C7H4BrClN2O2S |
| Molecular Weight | 295.5409 |
| SMILES | ClS(C1C2=C(N=CC=C2Br)NC=1)(=O)=O |
| Synonyms | 4-bromo-1H-pyrrolo[2,3-b]pyridine-3-sulfonyl chloride,
1210227-31-8,
AC1Q3VN8,
CTK5I8806,
AKOS026729067,
ZINC100590684,
NE60806,
EN300-52708,
|
| Complexity | 318 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 293.887g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 295.535g/mol |
| Monoisotopic Mass | 293.887g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 71.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number