| CAS Number | 1185029-09-7 |
| Catalog Number | AG009QOD(AGN-PC-0WB7A2) |
| Chemical Name | [(2-isopropyl-4-methyl-1,3-thiazol-5-yl)methyl]amine dihydrochloride |
| IUPAC Name | (4-methyl-2-propan-2-yl-1,3-thiazol-5-yl)methanamine;dihydrochloride |
| InChI | InChI=1S/C8H14N2S.2ClH/c1-5(2)8-10-6(3)7(4-9)11-8;;/h5H,4,9H2,1-3H3;2*1H |
| InChI Key | INKHXSIRUDYVJK-UHFFFAOYSA-N |
| MDL Number | MFCD12026785 |
| Molecular Formula | C8H16Cl2N2S |
| Molecular Weight | 243.1970 |
| SMILES | NCC1=C(C)N=C(C(C)C)S1.Cl.Cl |
| Synonyms | 1185029-09-7,
[(2-isopropyl-4-methyl-1,3-thiazol-5-yl)methyl]amine dihydrochloride,
(2-Isopropyl-4-methylthiazol-5-yl)methanamine dihydrochloride,
C8H16Cl2N2S,
CTK8F1680,
ZX-CM006101,
0108AD,
MFCD12026785,
AKOS027426084,
(2-isopropyl-4-methyl-1,3-thiazol-5-yl)methanamine dihydrochloride,
(2-isopropyl-4-methyl-1,3-thiazol-5-yl)methylamine dihydrochloride,
1-(2-ISOPROPYL-4-METHYL-1,3-THIAZOL-5-YL)METHANAMINE DIHYDROCHLORIDE,
(2-ISOPROPYL-4-METHYL-1,3-THIAZOL-5-YL)-METHYLAMINE DIHYDROCHLORIDE,
1119450-67-7,
|
| Complexity | 127 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 242.041g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 243.19g/mol |
| Monoisotopic Mass | 242.041g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 67.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number