| CAS Number | 1197504-90-7 |
| Catalog Number | AG019WOV(AGN-PC-0WO80Q) |
| Chemical Name | 2,2,2-trifluoroethyl N-[(oxolan-2-yl)methyl]carbamate |
| IUPAC Name | 2,2,2-trifluoroethyl N-(oxolan-2-ylmethyl)carbamate |
| InChI | InChI=1S/C8H12F3NO3/c9-8(10,11)5-15-7(13)12-4-6-2-1-3-14-6/h6H,1-5H2,(H,12,13) |
| InChI Key | UDQZHVIQWBZFCA-UHFFFAOYSA-N |
| MDL Number | MFCD13195852 |
| Molecular Formula | C8H12F3NO3 |
| Molecular Weight | 227.1810 |
| SMILES | FC(COC(NCC1OCCC1)=O)(F)F |
| Synonyms | 2,2,2-trifluoroethyl N-(oxolan-2-ylmethyl)carbamate,
1197504-90-7,
EN300-52688,
AC1Q4KBA,
CTK7G9614,
AKOS009102134,
MCULE-8249461220,
NE15710,
2,2,2-trifluoroethyl N-[(oxolan-2-yl)methyl]carbamate,
Z803129940,
|
| Complexity | 220 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 227.077g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 227.183g/mol |
| Monoisotopic Mass | 227.077g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 47.6A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number