| CAS Number | 13948-37-3 |
| Catalog Number | AG01BFTC |
| Chemical Name | 2-Benzyl-1,3-thiazole |
| IUPAC Name | 2-benzyl-1,3-thiazole |
| InChI | InChI=1S/C10H9NS/c1-2-4-9(5-3-1)8-10-11-6-7-12-10/h1-7H,8H2 |
| InChI Key | ABCSPNANFXDHDU-UHFFFAOYSA-N |
| MDL Number | MFCD26887650 |
| Molecular Formula | C10H9NS |
| Molecular Weight | 175.2502 |
| SMILES | C(C1=CC=CC=C1)C1SC=CN=1 |
| Synonyms | 2-benzyl-1,3-thiazole,
13948-37-3,
2-benzylthiazole,
phenylmethylthiazole,
SCHEMBL378027,
ZINC98209918,
NE31500,
|
| Complexity | 132 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 175.046g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 175.249g/mol |
| Monoisotopic Mass | 175.046g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 41.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number