| CAS Number | 933698-13-6 |
| Catalog Number | AG00GVUZ(AGN-PC-0WB6JD) |
| Chemical Name | 2-{4H,5H,6H-cyclopenta[d][1,3]thiazol-2-yl}ethan-1-amine |
| IUPAC Name | 2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)ethanamine |
| InChI | InChI=1S/C8H12N2S/c9-5-4-8-10-6-2-1-3-7(6)11-8/h1-5,9H2 |
| InChI Key | GANVHFMPFZZVEM-UHFFFAOYSA-N |
| MDL Number | MFCD09904585 |
| Molecular Formula | C8H12N2S |
| Molecular Weight | 168.2593 |
| SMILES | NCCC1SC2=C(CCC2)N=1 |
| Synonyms | 933698-13-6,
2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)ethanamine,
ZINC11886680,
AKOS000188154,
MCULE-7823868882,
AJ-60331,
Y-5961,
2-(5,6-Dihydro-4H-cyclopenta[d]thiazol-2-yl)ethanamine,
F0001-2732,
2-{4H,5H,6H-cyclopenta[d][1,3]thiazol-2-yl}ethan-1-amine,
|
| Complexity | 140 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 168.072g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 168.258g/mol |
| Monoisotopic Mass | 168.072g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 67.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number