| CAS Number | 1087788-98-4 |
| Catalog Number | AG019QVG |
| Chemical Name | 2,2,2-Trifluoroethyl 4-fluoro-2-methylphenylcarbamate |
| IUPAC Name | 2,2,2-trifluoroethyl N-(4-fluoro-2-methylphenyl)carbamate |
| InChI | InChI=1S/C10H9F4NO2/c1-6-4-7(11)2-3-8(6)15-9(16)17-5-10(12,13)14/h2-4H,5H2,1H3,(H,15,16) |
| InChI Key | YFZVDAWTFFZTFN-UHFFFAOYSA-N |
| MDL Number | MFCD11099871 |
| Molecular Formula | C10H9F4NO2 |
| Molecular Weight | 251.1776 |
| SMILES | CC1=C(NC(OCC(F)(F)F)=O)C=CC(F)=C1 |
| Synonyms | 2,2,2-trifluoroethyl N-(4-fluoro-2-methylphenyl)carbamate,
1087788-98-4,
2,2,2-trifluoroethyl 4-fluoro-2-methylphenylcarbamate,
CTK7G6011,
ZINC32628901,
AKOS005874827,
NE57349,
EN300-88442,
AC1Q2G2R,
|
| Complexity | 270 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 251.056941g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 251.18g/mol |
| Monoisotopic Mass | 251.056941g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 38.3Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number