| CAS Number | 20566-93-2 |
| Catalog Number | AG00BCOV(AGN-PC-0WAO9Z) |
| Chemical Name | 2-Chloro-5-(trifluoromethyl)benzamide |
| IUPAC Name | 2-chloro-5-(trifluoromethyl)benzamide |
| InChI | InChI=1S/C8H5ClF3NO/c9-6-2-1-4(8(10,11)12)3-5(6)7(13)14/h1-3H,(H2,13,14) |
| InChI Key | IRUCBTSYBQHPLT-UHFFFAOYSA-N |
| MDL Number | MFCD01631467 |
| Molecular Formula | C8H5ClF3NO |
| Molecular Weight | 223.5796 |
| SMILES | C1=C(C=CC(=C1C(N)=O)Cl)C(F)(F)F |
| Synonyms | 2-chloro-5-(trifluoromethyl)benzamide,
20566-93-2,
AC1MCNK4,
SCHEMBL629096,
CTK7D2602,
DTXSID20378753,
IRUCBTSYBQHPLT-UHFFFAOYSA-N,
ZINC2382124,
2-chloro-5-trifluoromethyl-benzamide,
6957AD,
MFCD01631467,
SBB096543,
AKOS015849893,
JS-4207,
TR-039829,
ST51041486,
2-Chloro-5-(trifluoromethyl)benzamide, AldrichCPR,
C8H5ClF3NO,
ZINC02382124,
CID2773854,
|
| Complexity | 231 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 223.001g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 223.579g/mol |
| Monoisotopic Mass | 223.001g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 43.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number