| CAS Number | 1087788-56-4 |
| Catalog Number | AG019QSE |
| Chemical Name | 2,2,2-Trifluoroethyl 5-chloro-2-methylphenylcarbamate |
| IUPAC Name | 2,2,2-trifluoroethyl N-(5-chloro-2-methylphenyl)carbamate |
| InChI | InChI=1S/C10H9ClF3NO2/c1-6-2-3-7(11)4-8(6)15-9(16)17-5-10(12,13)14/h2-4H,5H2,1H3,(H,15,16) |
| InChI Key | RJPMJKTZLUDUGP-UHFFFAOYSA-N |
| MDL Number | MFCD11099786 |
| Molecular Formula | C10H9ClF3NO2 |
| Molecular Weight | 267.6322 |
| SMILES | CC1=C(NC(OCC(F)(F)F)=O)C=C(Cl)C=C1 |
| Synonyms | 2,2,2-trifluoroethyl N-(5-chloro-2-methylphenyl)carbamate,
1087788-56-4,
2,2,2-trifluoroethyl 5-chloro-2-methylphenylcarbamate,
AC1Q2G2N,
CTK7G4471,
ZINC32628755,
AKOS009101942,
MCULE-8755887973,
NE41009,
EN300-88261,
Z1713582969,
|
| Complexity | 273 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 267.027g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 267.632g/mol |
| Monoisotopic Mass | 267.027g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 38.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number