Catalog | OFC15453879 |
CAS | 15453-87-9 |
Category | Fluorinated Metal Complexes |
Synonyms | Indium,Tris(1,1,1-Trifluoro-2,4-Pentanedionato-Ko,Ko')-(9ci) |
Purity | >98% |
MDL Number | MFCD00058830 |
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IUPAC Name | (Z)-4-bis[[(Z)-5,5,5-trifluoro-4-oxopent-2-en-2-yl]oxy]indiganyloxy-1,1,1-trifluoropent-3-en-2-one |
InChI | InChI=1S/3C5H5F3O2.In/c3*1-3(9)2-4(10)5(6,7)8;/h3*2,9H,1H3;/q;;;+3/p-3/b3*3-2-; |
InChI Key | JSFSIUKMFCYGBL-IQMQLBNYSA-K |
Isomeric SMILES | C/C(=C/C(=O)C(F)(F)F)/O[In](O/C(=C\C(=O)C(F)(F)F)/C)O/C(=C\C(=O)C(F)(F)F)/C |
Molecular Formula | C15H12F9InO6 |
Molecular Weight | 574.05 |
Storage | Inert atmosphere, 2-8 °C |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 15 |
Rotatable Bond Count | 9 |
Exact Mass | 573.9528953 g/mol |
Monoisotopic Mass | 573.9528953 g/mol |
Topological Polar Surface Area | 78.9Ų |
Heavy Atom Count | 31 |
Formal Charge | 0 |
Complexity | 686 |
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