| CAS Number | 774158-28-0 |
| Catalog Number | AG00KLLY(AGN-PC-0WBPU7) |
| Chemical Name | 4-(Chloromethyl)-2-cyclopentyl-1,3-thiazole |
| IUPAC Name | 4-(chloromethyl)-2-cyclopentyl-1,3-thiazole |
| InChI | InChI=1S/C9H12ClNS/c10-5-8-6-12-9(11-8)7-3-1-2-4-7/h6-7H,1-5H2 |
| InChI Key | IBRFKFTYPXFYQQ-UHFFFAOYSA-N |
| MDL Number | MFCD12768695 |
| Molecular Formula | C9H12ClNS |
| Molecular Weight | 201.7163 |
| SMILES | ClCC1N=C(C2CCCC2)SC=1 |
| Synonyms | 4-(chloromethyl)-2-cyclopentyl-1,3-thiazole,
774158-28-0,
AC1Q3U3A,
SCHEMBL9065445,
CTK6H6770,
ZINC34525965,
AKOS010145391,
NE17432,
EN300-59781,
F8889-3998,
|
| Complexity | 148 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 201.038g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 201.712g/mol |
| Monoisotopic Mass | 201.038g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 41.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number