Catalog | OFC1000775187 |
CAS | 1000775-18-7 |
Category | Fluorinated Quinolines |
Synonyms | Quinolin-6-yl trifluoroacetate |
Purity | 97% |
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IUPAC Name | quinolin-6-yl 2,2,2-trifluoroacetate |
InChI | InChI=1S/C11H6F3NO2/c12-11(13,14)10(16)17-8-3-4-9-7(6-8)2-1-5-15-9/h1-6H |
InChI Key | VSHPSUYOQMHUET-UHFFFAOYSA-N |
Isomeric SMILES | C1=CC2=C(C=CC(=C2)OC(=O)C(F)(F)F)N=C1 |
Molecular Formula | C11H6F3NO2 |
Molecular Weight | 241.17 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 6 |
Rotatable Bond Count | 2 |
Exact Mass | 241.03506292 g/mol |
Monoisotopic Mass | 241.03506292 g/mol |
Topological Polar Surface Area | 39.2Ų |
Heavy Atom Count | 17 |
Formal Charge | 0 |
Complexity | 293 |
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