| CAS Number | 1098361-20-6 |
| Catalog Number | AG019KTA |
| Chemical Name | 2-chloro-N-[4-acetamido-2-(trifluoromethyl)phenyl]acetamide |
| IUPAC Name | N-[4-acetamido-2-(trifluoromethyl)phenyl]-2-chloroacetamide |
| InChI | InChI=1S/C11H10ClF3N2O2/c1-6(18)16-7-2-3-9(17-10(19)5-12)8(4-7)11(13,14)15/h2-4H,5H2,1H3,(H,16,18)(H,17,19) |
| InChI Key | HPHWDPIGOKSTAL-UHFFFAOYSA-N |
| MDL Number | MFCD12655063 |
| Molecular Formula | C11H10ClF3N2O2 |
| Molecular Weight | 294.6575 |
| SMILES | CC(NC1=CC(C(F)(F)F)=C(NC(CCl)=O)C=C1)=O |
| Synonyms | 2-chloro-N-[4-acetamido-2-(trifluoromethyl)phenyl]acetamide,
1098361-20-6,
ZINC37389639,
AKOS009133000,
Z1562121864,
|
| Complexity | 349 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 294.038g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 294.658g/mol |
| Monoisotopic Mass | 294.038g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 58.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.2 |
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Certificate of Analysis
Lot Number