| CAS Number | 89180-91-6 |
| Catalog Number | AG00JT01(AGN-PC-0WCN59) |
| Chemical Name | 5-Chloro-3-(2-methoxyethyl)-1,2,4-thiadiazole |
| IUPAC Name | 5-chloro-3-(2-methoxyethyl)-1,2,4-thiadiazole |
| InChI | InChI=1S/C5H7ClN2OS/c1-9-3-2-4-7-5(6)10-8-4/h2-3H2,1H3 |
| InChI Key | MKAOOWRIYBWSMA-UHFFFAOYSA-N |
| MDL Number | MFCD14707359 |
| Molecular Formula | C5H7ClN2OS |
| Molecular Weight | 178.6399 |
| SMILES | COCCC1N=C(Cl)SN=1 |
| Synonyms | 5-chloro-3-(2-methoxyethyl)-1,2,4-thiadiazole,
89180-91-6,
KS-00001KTN,
MFCD14707359,
STL301951,
ZINC47218936,
AKOS014313875,
MCULE-3681535840,
L-2572,
F2111-0063,
Z1954800408,
|
| Complexity | 106 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 177.997g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 178.634g/mol |
| Monoisotopic Mass | 177.997g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 63.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number