| CAS Number | 132993-23-8 |
| Catalog Number | AG00NI02(AGN-PC-0NDTST) |
| Chemical Name | 4-Fluorophenyl trifluoromethanesulfonate |
| IUPAC Name | (4-fluorophenyl) trifluoromethanesulfonate |
| InChI | InChI=1S/C7H4F4O3S/c8-5-1-3-6(4-2-5)14-15(12,13)7(9,10)11/h1-4H |
| InChI Key | FEHSEZUGDOTYAE-UHFFFAOYSA-N |
| MDL Number | MFCD18379778 |
| Molecular Formula | C7H4F4O3S |
| Molecular Weight | 244.1635 |
| SMILES | O=S(C(F)(F)F)(OC1=CC=C(F)C=C1)=O |
| Synonyms | 4-Fluorophenyl trifluoromethanesulfonate,
132993-23-8,
4-Fluorophenyltriflate,
SCHEMBL776070,
FEHSEZUGDOTYAE-UHFFFAOYSA-N,
ZX-RL003654,
ZINC100542050,
FCH1723170,
p-fluorophenyl trifluoromethanesulfonate,
PC500026,
1-(Trifluoromethylsulfonyloxy)-4-fluorobenzene,
CID10977674,
1-fluoro-4-(trifluoromethylsulfonyloxy)benzene,
|
| Complexity | 297 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 243.982g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 7 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 244.16g/mol |
| Monoisotopic Mass | 243.982g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 51.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number