| CAS Number | 161823-02-5 |
| Catalog Number | AG00AWZD |
| Chemical Name | 4-Bromothieno[3,2-c]pyridine |
| IUPAC Name | 4-bromothieno[3,2-c]pyridine |
| InChI | InChI=1S/C7H4BrNS/c8-7-5-2-4-10-6(5)1-3-9-7/h1-4H |
| InChI Key | KFLHTKWGSANOOL-UHFFFAOYSA-N |
| MDL Number | MFCD11870052 |
| Molecular Formula | C7H4BrNS |
| Molecular Weight | 214.0824 |
| SMILES | BrC1=NC=CC2=C1C=CS2 |
| Synonyms | 4-bromothieno[3,2-c]pyridine,
161823-02-5,
SCHEMBL1900422,
KFLHTKWGSANOOL-UHFFFAOYSA-N,
Thieno[3,2-c]pyridine, 4-bromo-,
ZINC44628845,
AKOS022690520,
CS-0081737,
|
| Complexity | 131 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 212.925g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 214.08g/mol |
| Monoisotopic Mass | 212.925g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 41.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number