| CAS Number | 852399-70-3 |
| Catalog Number | AG00G3VM |
| Chemical Name | N-(Benzo[d]thiazol-2-yl)-2-chloro-N-ethylacetamide |
| IUPAC Name | N-(1,3-benzothiazol-2-yl)-2-chloro-N-ethylacetamide |
| InChI | InChI=1S/C11H11ClN2OS/c1-2-14(10(15)7-12)11-13-8-5-3-4-6-9(8)16-11/h3-6H,2,7H2,1H3 |
| InChI Key | XHZMFHWLTWEYOK-UHFFFAOYSA-N |
| MDL Number | MFCD06655537 |
| Molecular Formula | C11H11ClN2OS |
| Molecular Weight | 254.7358 |
| SMILES | O=C(N(C1=NC2=CC=CC=C2S1)CC)CCl |
| Synonyms | N-(1,3-benzothiazol-2-yl)-2-chloro-N-ethylacetamide,
N-1,3-benzothiazol-2-yl-2-chloro-N-ethylacetamide,
852399-70-3,
N-(Benzo[d]thiazol-2-yl)-2-chloro-N-ethylacetamide,
AC1Q2YMY,
AC1NLQ49,
CTK6E7699,
ZINC4205920,
AKOS027427161,
MCULE-6641333324,
NE13374,
EN300-12855,
SR-01000065937,
J-523379,
SR-01000065937-1,
Z85923130,
ZINC04205920,
CID4962101,
|
| Complexity | 264 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 254.028g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 254.732g/mol |
| Monoisotopic Mass | 254.028g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 61.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number