| CAS Number | 1432679-66-7 |
| Catalog Number | AG019WA3 |
| Chemical Name | 2,2,2-trifluoroethyl N-(2-acetylphenyl)carbamate |
| IUPAC Name | 2,2,2-trifluoroethyl N-(2-acetylphenyl)carbamate |
| InChI | InChI=1S/C11H10F3NO3/c1-7(16)8-4-2-3-5-9(8)15-10(17)18-6-11(12,13)14/h2-5H,6H2,1H3,(H,15,17) |
| InChI Key | APMDAMQCIXBBAT-UHFFFAOYSA-N |
| MDL Number | MFCD23701988 |
| Molecular Formula | C11H10F3NO3 |
| Molecular Weight | 261.1972 |
| SMILES | CC(C1=C(NC(OCC(F)(F)F)=O)C=CC=C1)=O |
| Synonyms | 2,2,2-trifluoroethyl N-(2-acetylphenyl)carbamate,
1432679-66-7,
ZINC90225821,
NE57033,
|
| Complexity | 317 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 261.061g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 261.2g/mol |
| Monoisotopic Mass | 261.061g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 55.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number