| CAS Number | 306762-46-9 |
| Catalog Number | AG007JZE(AGN-PC-0R644N) |
| Chemical Name | Benzo[b]thiophene,5-bromo-2-iodo- |
| IUPAC Name | 5-bromo-2-iodo-1-benzothiophene |
| InChI | InChI=1S/C8H4BrIS/c9-6-1-2-7-5(3-6)4-8(10)11-7/h1-4H |
| InChI Key | GXOJIGFIISCLSK-UHFFFAOYSA-N |
| MDL Number | MFCD08706227 |
| Molecular Formula | C8H4BrIS |
| Molecular Weight | 338.9908 |
| SMILES | IC1=CC2=CC(Br)=CC=C2S1 |
| Synonyms | 306762-46-9,
5-Bromo-2-iodo-benzo[b]thiophene,
5-Bromo-2-iodobenzo[b]thiophene,
Benzo[b]thiophene,5-bromo-2-iodo-,
5-bromo-2-iodo-1-benzothiophene,
CTK4G5567,
DTXSID00592213,
MFCD08706227,
ZINC15042988,
Benzo[b]thiophene, 5-bromo-2-iodo-,
AKOS015969323,
FCH1389966,
ACM306762469,
J-018052,
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| Complexity | 153 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 337.826g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 338.988g/mol |
| Monoisotopic Mass | 337.826g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 28.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.3 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number