| CAS Number | 80910-70-9 |
| Catalog Number | AG00ID56(AGN-PC-0WR4H3) |
| Chemical Name | 2-chloro-N-[2-(2-methoxyethoxy)-5-(trifluoromethyl)phenyl]acetamide |
| IUPAC Name | 2-chloro-N-[2-(2-methoxyethoxy)-5-(trifluoromethyl)phenyl]acetamide |
| InChI | InChI=1S/C12H13ClF3NO3/c1-19-4-5-20-10-3-2-8(12(14,15)16)6-9(10)17-11(18)7-13/h2-3,6H,4-5,7H2,1H3,(H,17,18) |
| InChI Key | AQFVHMNPUFIIKH-UHFFFAOYSA-N |
| MDL Number | MFCD03965301 |
| Molecular Formula | C12H13ClF3NO3 |
| Molecular Weight | 311.6847 |
| SMILES | COCCOC1=C(NC(CCl)=O)C=C(C(F)(F)F)C=C1 |
| Synonyms | 2-chloro-N-[2-(2-methoxyethoxy)-5-(trifluoromethyl)phenyl]acetamide,
80910-70-9,
2-Chloro-N-[2-(2-methoxy-ethoxy)-5-trifluoromethyl-phenyl]-acetamide,
AC1Q4GAW,
AC1M5VE7,
CTK7B3763,
ZINC3269817,
MFCD03965301,
AKOS000115725,
MCULE-1158689405,
NE38269,
EN300-01962,
ZINC03269817,
CID2386142,
|
| Complexity | 315 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 311.054g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 20 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 311.685g/mol |
| Monoisotopic Mass | 311.054g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 47.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number