| CAS Number | 4115-14-4 |
| Catalog Number | AG01BRIX(AGN-PC-00KJ44) |
| Chemical Name | Dimethyl-1,2,4-thiadiazole |
| IUPAC Name | 3,5-dimethyl-1,2,4-thiadiazole |
| InChI | InChI=1S/C4H6N2S/c1-3-5-4(2)7-6-3/h1-2H3 |
| InChI Key | MPBPVACPFBSAFW-UHFFFAOYSA-N |
| MDL Number | MFCD00509181 |
| Molecular Formula | C4H6N2S |
| Molecular Weight | 114.1688 |
| SMILES | CC1N=C(C)SN=1 |
| Synonyms | 3,5-dimethyl-1,2,4-thiadiazole,
Dimethyl-1,2,4-thiadiazole,
4115-14-4,
SCHEMBL30693,
3,5-dimethyl-[1,2,4]thiadiazole,
ZINC39375076,
|
| Complexity | 66.7 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 114.025g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 7 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 114.166g/mol |
| Monoisotopic Mass | 114.025g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 54A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number