57483642 1 2 3 4 5 6 7 8 39 9 9 9 8 8 6 6 5 -1 2 3 4 5 6 7 7 7 7 8 8 8 1 1 1 1 2 1 1 5 255 1 2 3 4 5 6 7 8 1.049 0 0.366 1.366 2.5981 1.732 0.866 1.732 0 2.866 4.232 2.5 3.366 4.866 3.366 3.866 -1 Compound Canonicalized 5 2012.05.21 1 Compound Complexity 7 E_COMPLEXITY 3.4.6.11 Cactvs xemistry.com 2019.06.18 77.9 Count Hydrogen Bond Acceptor 5 E_NHACCEPTORS 3.4.6.11 Cactvs xemistry.com 2019.06.18 5 Count Hydrogen Bond Donor 5 E_NHDONORS 3.4.6.11 Cactvs xemistry.com 2019.06.18 0 Count Rotatable Bond 5 E_NROTBONDS 3.4.6.11 Cactvs xemistry.com 2019.06.18 0 Fingerprint SubStructure Keys 16 extended 2 E_SCREEN 3.4.6.11 Cactvs xemistry.com 2019.06.18 0000037100403180000000000200000000000000000000000000000000000000000000000000000B000000000000000080100008000000000800009008000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000 IUPAC Name Allowed 1 2.6.6 LexiChem openeye.com 2019.06.18 2,2,2-trifluoroacetate;yttrium IUPAC Name CAS-like Style 1 2.6.6 LexiChem openeye.com 2019.06.18 2,2,2-trifluoroacetate;yttrium IUPAC Name Markup 1 2.6.6 LexiChem openeye.com 2019.06.18 2,2,2-trifluoroacetate;yttrium IUPAC Name Preferred 1 2.6.6 LexiChem openeye.com 2019.06.18 2,2,2-trifluoroacetate;yttrium IUPAC Name Systematic 1 2.6.6 LexiChem openeye.com 2019.06.18 2,2,2-tris(fluoranyl)ethanoate;yttrium IUPAC Name Traditional 1 2.6.6 LexiChem openeye.com 2019.06.18 2,2,2-trifluoroacetate;yttrium InChI Standard 1 1.0.5 InChI iupac.org 2019.06.18 InChI=1S/C2HF3O2.Y/c3-2(4,5)1(6)7;/h(H,6,7);/p-1 InChIKey Standard 1 1.0.5 InChI iupac.org 2019.06.18 OWMNIIXIMJDZDV-UHFFFAOYSA-M Mass Exact 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 201.890877 Molecular Formula 1 2.1 PubChem ncbi.nlm.nih.gov 2019.06.18 C2F3O2Y- Molecular Weight 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 201.92 SMILES Canonical 1 2.1.5 OEChem openeye.com 2019.06.18 C(=O)(C(F)(F)F)[O-].[Y] SMILES Isomeric 1 2.1.5 OEChem openeye.com 2019.06.18 C(=O)(C(F)(F)F)[O-].[Y] Topological Polar Surface Area 7 E_TPSA 3.4.6.11 Cactvs xemistry.com 2019.06.18 40.1 Weight MonoIsotopic 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 201.890877 8 0 0 0 0 0 0 0 2 -1