| CAS Number | 35634-06-1 |
| Catalog Number | AG00I72M(AGN-PC-00M1ZU) |
| Chemical Name | 3-Bromo-2-methanesulfonylthiophene |
| IUPAC Name | 3-bromo-2-methylsulfonylthiophene |
| InChI | InChI=1S/C5H5BrO2S2/c1-10(7,8)5-4(6)2-3-9-5/h2-3H,1H3 |
| InChI Key | NZZYSMIJYPWGLJ-UHFFFAOYSA-N |
| MDL Number | MFCD30291198 |
| Molecular Formula | C5H5BrO2S2 |
| Molecular Weight | 241.1260 |
| SMILES | Brc1ccsc1S(=O)(=O)C |
| Synonyms | 3-Bromo-2-methanesulfonylthiophene,
35634-06-1,
SCHEMBL9843392,
3-bromo-2-thienyl methyl sulfone,
NZZYSMIJYPWGLJ-UHFFFAOYSA-N,
AKOS022683532,
3-bromo-2-(methylsulfonyl)thiophene,
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| Complexity | 206 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 239.891g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 241.117g/mol |
| Monoisotopic Mass | 239.891g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 70.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
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