| CAS Number | 1339678-16-8 |
| Catalog Number | AG01BBEC |
| Chemical Name | 2-chloro-5-(difluoromethyl)-1,3,4-thiadiazole |
| IUPAC Name | 2-chloro-5-(difluoromethyl)-1,3,4-thiadiazole |
| InChI | InChI=1S/C3HClF2N2S/c4-3-8-7-2(9-3)1(5)6/h1H |
| InChI Key | HRODDSHVEGLFMZ-UHFFFAOYSA-N |
| MDL Number | MFCD18344812 |
| Molecular Formula | C3HClF2N2S |
| Molecular Weight | 170.5682 |
| SMILES | FC(C1SC(Cl)=NN=1)F |
| Synonyms | 2-chloro-5-(difluoromethyl)-1,3,4-thiadiazole,
1339678-16-8,
ZINC71050536,
AKOS012692499,
|
| Complexity | 104 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 169.952g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 170.562g/mol |
| Monoisotopic Mass | 169.952g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 54A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number