| CAS Number | 1609403-73-7 |
| Catalog Number | AG00J2DK |
| Chemical Name | 5-(1-amino-1-methylethyl)-1,3,4-thiadiazol-2-amine trihydrochloride |
| IUPAC Name | 5-(2-aminopropan-2-yl)-1,3,4-thiadiazol-2-amine;trihydrochloride |
| InChI | InChI=1S/C5H10N4S.3ClH/c1-5(2,7)3-8-9-4(6)10-3;;;/h7H2,1-2H3,(H2,6,9);3*1H |
| InChI Key | AFODTYWVMMZOAE-UHFFFAOYSA-N |
| MDL Number | MFCD26959412 |
| Molecular Formula | C5H13Cl3N4S |
| Molecular Weight | 267.6075 |
| SMILES | S1C(N)=NN=C1C(C)(C)N.Cl.Cl.Cl |
| Synonyms | 5-(1-Amino-1-methylethyl)-1,3,4-thiadiazol-2-amine trihydrochloride,
1609403-73-7,
1255147-42-2,
ZX-CM009174,
MFCD26959412,
|
| Complexity | 127 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 4 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 265.993g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 5 |
| Isotope Atom Count | 0 |
| Molecular Weight | 267.597g/mol |
| Monoisotopic Mass | 265.993g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 106A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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