| CAS Number | 926246-11-9 |
| Catalog Number | AG019U9I(AGN-PC-0WOB49) |
| Chemical Name | 5-[(2-Methylphenyl)methyl]-1,3-thiazol-2-amine |
| IUPAC Name | 5-[(2-methylphenyl)methyl]-1,3-thiazol-2-amine |
| InChI | InChI=1S/C11H12N2S/c1-8-4-2-3-5-9(8)6-10-7-13-11(12)14-10/h2-5,7H,6H2,1H3,(H2,12,13) |
| InChI Key | HVBQNABRJKMLAU-UHFFFAOYSA-N |
| MDL Number | MFCD08443447 |
| Molecular Formula | C11H12N2S |
| Molecular Weight | 204.2914 |
| SMILES | CC1=C(CC2SC(N)=NC=2)C=CC=C1 |
| Synonyms | 5-[(2-methylphenyl)methyl]-1,3-thiazol-2-amine,
5-(2-methylbenzyl)-1,3-thiazol-2-amine,
926246-11-9,
AC1Q2F10,
SCHEMBL16061555,
CTK7E1166,
5-(2-methylbenzyl)thiazol-2-amine,
ZINC21953082,
AKOS000126394,
MCULE-9321055379,
NE48379,
NCGC00334638-01,
EN300-41003,
AB01327272-02,
Z228586446,
|
| Complexity | 186 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 204.072g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 204.291g/mol |
| Monoisotopic Mass | 204.072g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 67.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number