| CAS Number | 1228880-15-6 |
| Catalog Number | AG019YY6(AGN-PC-0WOSCQ) |
| Chemical Name | [5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]methanamine hydrochloride |
| IUPAC Name | (5-propan-2-yl-1,3,4-thiadiazol-2-yl)methanamine;hydrochloride |
| InChI | InChI=1S/C6H11N3S.ClH/c1-4(2)6-9-8-5(3-7)10-6;/h4H,3,7H2,1-2H3;1H |
| InChI Key | LFLGJNAEQKRWED-UHFFFAOYSA-N |
| MDL Number | MFCD11841159 |
| Molecular Formula | C6H12ClN3S |
| Molecular Weight | 193.6976 |
| SMILES | NCC1=NN=C(C(C)C)S1.[H]Cl |
| Synonyms | [5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]methanamine hydrochloride,
1228880-15-6,
AKOS026742373,
NE39495,
RP25284,
|
| Complexity | 107 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 193.044g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 193.693g/mol |
| Monoisotopic Mass | 193.044g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 80A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number