| CAS Number | 1803560-88-4 |
| Catalog Number | AG01B84R(AGN-PC-0WOURW) |
| Chemical Name | 3-propyl-2,5-dihydro-1,2,4-thiadiazol-5-imine hydrochloride |
| IUPAC Name | 3-propyl-1,2,4-thiadiazol-5-amine;hydrochloride |
| InChI | InChI=1S/C5H9N3S.ClH/c1-2-3-4-7-5(6)9-8-4;/h2-3H2,1H3,(H2,6,7,8);1H |
| InChI Key | XKFJUPPSVZLCOU-UHFFFAOYSA-N |
| MDL Number | MFCD28656855 |
| Molecular Formula | C5H10ClN3S |
| Molecular Weight | 179.6710 |
| SMILES | Cl.CCCC1NSC(=N)N=1 |
| Synonyms | 1803560-88-4,
3-propyl-2,5-dihydro-1,2,4-thiadiazol-5-imine hydrochloride,
AKOS026744019,
|
| Complexity | 88.3 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 179.028g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 179.666g/mol |
| Monoisotopic Mass | 179.028g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 80A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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