| CAS Number | 1330756-14-3 |
| Catalog Number | AG00HSQS(AGN-PC-0WB604) |
| Chemical Name | 5-Ethyl-1,3,4-thiadiazol-2-ol |
| IUPAC Name | 5-ethyl-3H-1,3,4-thiadiazol-2-one |
| InChI | InChI=1S/C4H6N2OS/c1-2-3-5-6-4(7)8-3/h2H2,1H3,(H,6,7) |
| InChI Key | PDPCVHUXVHMHOP-UHFFFAOYSA-N |
| MDL Number | MFCD19982735 |
| Molecular Formula | C4H6N2OS |
| Molecular Weight | 130.1682 |
| SMILES | S1C(CC)=NN=C1O |
| Synonyms | 5-Ethyl-1,3,4-thiadiazol-2-ol,
1330756-14-3,
SCHEMBL12377776,
ALBB-017798,
ZX-AN016484,
ZX-CM009942,
3791AD,
MFCD19982735,
ZINC67425283,
1,3,4-thiadiazol-2-ol, 5-ethyl-,
AKOS015959971,
FCH1314975,
Y-8129,
C4H6N2OS,
|
| Complexity | 143 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 130.02g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 130.165g/mol |
| Monoisotopic Mass | 130.02g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 66.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number