| CAS Number | 937602-31-8 |
| Catalog Number | AG00ISSF(AGN-PC-0WB026) |
| Chemical Name | 2,4,6-Trifluoro-N-methoxy-N-methylbenzamide |
| IUPAC Name | 2,4,6-trifluoro-N-methoxy-N-methylbenzamide |
| InChI | InChI=1S/C9H8F3NO2/c1-13(15-2)9(14)8-6(11)3-5(10)4-7(8)12/h3-4H,1-2H3 |
| InChI Key | HLURWTIDWPYHAK-UHFFFAOYSA-N |
| MDL Number | MFCD08689800 |
| Molecular Formula | C9H8F3NO2 |
| Molecular Weight | 219.1605 |
| SMILES | FC1=C(C(=O)N(C)OC)C(=CC(=C1)F)F |
| Synonyms | 2,4,6-trifluoro-N-methoxy-N-methylbenzamide,
937602-31-8,
2,4,6-Trifluoro-N-methoxy-N-methylbenzenecarboxamide,
CTK7B4140,
KS-000026IN,
MFCD08689800,
SBB095731,
ZINC12336655,
AKOS005072951,
trifluoromethoxymethylbenzenecarboxamide,
HA-0833,
MCULE-3803701247,
RP12661,
AJ-61050,
N-methoxy-N-methyl(2,4,6-trifluorophenyl)carboxamide,
|
| Complexity | 227 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 219.051g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 219.163g/mol |
| Monoisotopic Mass | 219.051g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 29.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number