| CAS Number | 1171575-96-4 |
| Catalog Number | AG019UJ8 |
| Chemical Name | 5-[(3,4-Dimethylphenyl)methyl]-1,3-thiazol-2-amine hydrochloride |
| IUPAC Name | 5-[(3,4-dimethylphenyl)methyl]-1,3-thiazol-2-amine;hydrochloride |
| InChI | InChI=1S/C12H14N2S.ClH/c1-8-3-4-10(5-9(8)2)6-11-7-14-12(13)15-11;/h3-5,7H,6H2,1-2H3,(H2,13,14);1H |
| InChI Key | RCBIOJDQJKACMM-UHFFFAOYSA-N |
| MDL Number | MFCD11795703 |
| Molecular Formula | C12H15ClN2S |
| Molecular Weight | 254.7789 |
| SMILES | Cl.CC1=C(C)C=C(CC2SC(N)=NC=2)C=C1 |
| Synonyms | 5-[(3,4-dimethylphenyl)methyl]-1,3-thiazol-2-amine hydrochloride,
1171575-96-4,
AC1Q39BA,
CTK7E1145,
MCULE-7975939330,
NE49987,
EN300-41840,
Z425485000,
|
| Complexity | 210 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 254.064g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 254.776g/mol |
| Monoisotopic Mass | 254.064g/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