| CAS Number | 1210510-50-1 |
| Catalog Number | AG00J3D9(AGN-PC-0WB7NC) |
| Chemical Name | [1-(2,5-Dimethyl-1,3-thiazol-4-yl)ethyl]methylamine dihydrochloride |
| IUPAC Name | 1-(2,5-dimethyl-1,3-thiazol-4-yl)-N-methylethanamine;dihydrochloride |
| InChI | InChI=1S/C8H14N2S.2ClH/c1-5(9-4)8-6(2)11-7(3)10-8;;/h5,9H,1-4H3;2*1H |
| InChI Key | PTDFIVFSTWDCFH-UHFFFAOYSA-N |
| MDL Number | MFCD13031917 |
| Molecular Formula | C8H16Cl2N2S |
| Molecular Weight | 243.1970 |
| SMILES | C1(C(C)NC)=C(C)SC(C)=N1.Cl.Cl |
| Synonyms | 1210510-50-1,
1-(2,5-Dimethylthiazol-4-yl)-N-methylethanamine dihydrochloride,
[1-(2,5-Dimethyl-1,3-thiazol-4-yl)ethyl]methylamine dihydrochloride,
ZX-CM014472,
MFCD13031917,
AKOS027426151,
4102469-25G,
4102469-50G,
4102469-100G,
|
| Complexity | 129 |
| 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 | 53.2A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
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