| CAS Number | 878218-01-0 |
| Catalog Number | AG019PKZ(AGN-PC-0WOCQB) |
| Chemical Name | 2,2,2-trifluoroethyl N-methylcarbamate |
| IUPAC Name | 2,2,2-trifluoroethyl N-methylcarbamate |
| InChI | InChI=1S/C4H6F3NO2/c1-8-3(9)10-2-4(5,6)7/h2H2,1H3,(H,8,9) |
| InChI Key | SMYIKNCXRMTISP-UHFFFAOYSA-N |
| MDL Number | MFCD08239613 |
| Molecular Formula | C4H6F3NO2 |
| Molecular Weight | 157.0911 |
| SMILES | CNC(OCC(F)(F)F)=O |
| Synonyms | 2,2,2-trifluoroethyl N-methylcarbamate,
2,2,2-trifluoroethyl methylcarbamate,
878218-01-0,
AC1PMHEV,
SCHEMBL965595,
AC1Q40R0,
CTK6I4497,
ZINC8037175,
AKOS009089282,
EN300-24164,
Z172492212,
ZINC08037175,
CID9167280,
|
| Complexity | 122 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 157.035g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 157.092g/mol |
| Monoisotopic Mass | 157.035g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 38.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number