| CAS Number | 757221-05-9 |
| Catalog Number | AG019JRF(AGN-PC-0WODCX) |
| Chemical Name | N-[4-(chloromethyl)-1,3-thiazol-2-yl]-N-ethylacetamide |
| IUPAC Name | N-[4-(chloromethyl)-1,3-thiazol-2-yl]-N-ethylacetamide |
| InChI | InChI=1S/C8H11ClN2OS/c1-3-11(6(2)12)8-10-7(4-9)5-13-8/h5H,3-4H2,1-2H3 |
| InChI Key | QAHGTFJTWCLCBX-UHFFFAOYSA-N |
| MDL Number | MFCD06342777 |
| Molecular Formula | C8H11ClN2OS |
| Molecular Weight | 218.7037 |
| SMILES | CCN(C1SC=C(CCl)N=1)C(C)=O |
| Synonyms | N-[4-(chloromethyl)-1,3-thiazol-2-yl]-N-ethylacetamide,
757221-05-9,
AC1M0PDT,
AC1Q2YNV,
MLS001018876,
CHEMBL1531509,
CTK6E7757,
HMS2739L04,
ZINC2619111,
AKOS000117345,
MCULE-3635623488,
SMR000385428,
EN300-10196,
SR-01000054984,
SR-01000054984-1,
ZINC02619111,
CID2081014,
|
| Complexity | 191 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 218.028g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 218.699g/mol |
| Monoisotopic Mass | 218.028g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 61.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number