| CAS Number | 522647-42-3 |
| Catalog Number | AG01BXY7 |
| Chemical Name | 3-Bromo-5-Methyl-1,2,4-Thiadiazole |
| IUPAC Name | 3-bromo-5-methyl-1,2,4-thiadiazole |
| InChI | InChI=1S/C3H3BrN2S/c1-2-5-3(4)6-7-2/h1H3 |
| InChI Key | LAKMLPXDJDBSBF-UHFFFAOYSA-N |
| MDL Number | MFCD11848381 |
| Molecular Formula | C3H3BrN2S |
| Molecular Weight | 179.0383 |
| SMILES | CC1=NC(Br)=NS1 |
| Synonyms | 3-bromo-5-methyl-1,2,4-thiadiazole,
522647-42-3,
3-BROMO-5-METHYL-[1,2,4]THIADIAZOLE,
SCHEMBL6368952,
ZINC82397624,
AKOS022707998,
SC-26390,
|
| Complexity | 70 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 177.92g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 7 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 179.035g/mol |
| Monoisotopic Mass | 177.92g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 54A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number