| CAS Number | 57606-65-2 |
| Catalog Number | AG00F18P(AGN-PC-0JSQP8) |
| Chemical Name | m-Fluorophenyl trifluoromethanesulfonate |
| IUPAC Name | (3-fluorophenyl) trifluoromethanesulfonate |
| InChI | InChI=1S/C7H4F4O3S/c8-5-2-1-3-6(4-5)14-15(12,13)7(9,10)11/h1-4H |
| InChI Key | LKAKRVBLXMUOHC-UHFFFAOYSA-N |
| MDL Number | MFCD18974275 |
| Molecular Formula | C7H4F4O3S |
| Molecular Weight | 244.1635 |
| SMILES | Fc1cccc(c1)OS(=O)(=O)C(F)(F)F |
| Synonyms | m-Fluorophenyl trifluoromethanesulfonate,
57606-65-2,
LKAKRVBLXMUOHC-UHFFFAOYSA-N,
3-Fluorophenyl trifluoromethanesulfonate,
(3-fluorophenyl) trifluoromethanesulfonate,
AC1LB36Y,
SCHEMBL778690,
CTK5A7153,
DTXSID70338665,
ZX-RL003653,
ZINC114575766,
FCH2346869,
3-Fluorophenyl trifluoromethanesulphonate,
3-Fluorophenyl trifluoromethanesulfonate #,
PC500025,
CID550560,
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| Complexity | 305 |
| 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
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Certificate of Analysis
Lot Number