23693579 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 9 9 9 6 6 6 6 5 1 1 1 1 1 1 1 1 1 1 1 9 -1 1 2 3 4 5 5 5 5 6 6 6 7 7 7 8 8 8 9 9 9 9 6 9 10 11 7 12 13 8 14 15 16 17 18 7 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 5 255 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 2 2.5878 2.7866 3.7377 3.8606 4.7266 5.5926 6.4586 2.9945 4.2591 3.462 4.328 5.1251 5.9911 5.1941 6.1486 6.9956 6.7686 0.0722 -0.9458 0.9458 -0.7014 0.4677 -0.0323 0.4677 -0.0323 -0.0323 0.9426 0.9426 -0.5072 -0.5072 0.9426 0.9426 -0.5692 -0.3423 0.5046 0 Compound Canonicalized 5 2011.04.04 1 Compound Complexity 7 E_COMPLEXITY 3.408 Cactvs xemistry.com 2012.11.26 63.3 Count Hydrogen Bond Acceptor 5 E_NHACCEPTORS 3.408 Cactvs xemistry.com 2012.11.26 4 Count Hydrogen Bond Donor 5 E_NHDONORS 3.408 Cactvs xemistry.com 2012.11.26 0 Count Rotatable Bond 5 E_NROTBONDS 3.408 Cactvs xemistry.com 2012.11.26 2 Fingerprint SubStructure Keys 16 extended 2 E_SCREEN 3.408 Cactvs xemistry.com 2012.11.26 00000371C26001800040000000000000000000000000000000000000000000000000000000002418000000000008008000000200000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000 IUPAC Name Allowed 1 2.2.0 LexiChem openeye.com 2012.11.26 potassium;butyl(trifluoro)boranuide IUPAC Name CAS-like Style 1 2.2.0 LexiChem openeye.com 2012.11.26 potassium;butyl(trifluoro)boranuide IUPAC Name Preferred 1 2.2.0 LexiChem openeye.com 2012.11.26 potassium;butyl(trifluoro)boranuide IUPAC Name Systematic 1 2.2.0 LexiChem openeye.com 2012.11.26 potassium;butyl-tris(fluoranyl)boranuide IUPAC Name Traditional 1 2.2.0 LexiChem openeye.com 2012.11.26 potassium;butyl(trifluoro)boranuide InChI Standard 1 1.0.4 InChI iupac.org 2012.11.26 InChI=1S/C4H9BF3.K/c1-2-3-4-5(6,7)8;/h2-4H2,1H3;/q-1;+1 InChIKey Standard 1 1.0.4 InChI iupac.org 2012.11.26 XLHVTQCFJZFJSN-UHFFFAOYSA-N Mass Exact 7 2.1 PubChem ncbi.nlm.nih.gov 2012.11.26 164.038647 Molecular Formula 1 2.1 PubChem ncbi.nlm.nih.gov 2012.11.26 C4H9BF3K Molecular Weight 7 2.1 PubChem ncbi.nlm.nih.gov 2012.11.26 164.01877 SMILES Canonical 1 1.9.0 OEChem openeye.com 2012.11.26 [B-](CCCC)(F)(F)F.[K+] SMILES Isomeric 1 1.9.0 OEChem openeye.com 2012.11.26 [B-](CCCC)(F)(F)F.[K+] Topological Polar Surface Area 7 E_TPSA 3.408 Cactvs xemistry.com 2012.11.26 0 Weight MonoIsotopic 7 2.1 PubChem ncbi.nlm.nih.gov 2012.11.26 164.038647 9 0 0 0 0 0 0 0 2 1