About 1-bromo-4-(trifluoromethyl)benzene;methyl 3-[4-(4-methylphenyl)piperidin-1-yl]-2-phenylquinoxaline-6-carboxylate;3-[4-(4-methylphenyl)piperidin-1-yl]-2-phenylquinoxaline-6-carboxylic acid;pyridin-4-ylboronic acid;4-[4-(trifluoromethyl)phenyl]piperidine;4-[4-(trifluoromethyl)phenyl]pyridine
1-bromo-4-(trifluoromethyl)benzene;methyl 3-[4-(4-methylphenyl)piperidin-1-yl]-2-phenylquinoxaline-6-carboxylate;3-[4-(4-methylphenyl)piperidin-1-yl]-2-phenylquinoxaline-6-carboxylic acid;pyridin-4-ylboronic acid;4-[4-(trifluoromethyl)phenyl]piperidine;4-[4-(trifluoromethyl)phenyl]pyridine (PubChem CID 162209070) has the molecular formula C91H84BBrF9N9O6
and a molecular weight of 1661.43 g/mol. Its IUPAC name is 1-bromo-4-(trifluoromethyl)benzene;methyl 3-[4-(4-methylphenyl)piperidin-1-yl]-2-phenylquinoxaline-6-carboxylate;3-[4-(4-methylphenyl)piperidin-1-yl]-2-phenylquinoxaline-6-carboxylic acid;pyridin-4-ylboronic acid;4-[4-(trifluoromethyl)phenyl]piperidine;4-[4-(trifluoromethyl)phenyl]pyridine.
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Frequently Asked Questions
What is the IUPAC name of 1-bromo-4-(trifluoromethyl)benzene;methyl 3-[4-(4-methylphenyl)piperidin-1-yl]-2-phenylquinoxaline-6-carboxylate;3-[4-(4-methylphenyl)piperidin-1-yl]-2-phenylquinoxaline-6-carboxylic acid;pyridin-4-ylboronic acid;4-[4-(trifluoromethyl)phenyl]piperidine;4-[4-(trifluoromethyl)phenyl]pyridine?
The IUPAC name of 1-bromo-4-(trifluoromethyl)benzene;methyl 3-[4-(4-methylphenyl)piperidin-1-yl]-2-phenylquinoxaline-6-carboxylate;3-[4-(4-methylphenyl)piperidin-1-yl]-2-phenylquinoxaline-6-carboxylic acid;pyridin-4-ylboronic acid;4-[4-(trifluoromethyl)phenyl]piperidine;4-[4-(trifluoromethyl)phenyl]pyridine (CID 162209070) is 1-bromo-4-(trifluoromethyl)benzene;methyl 3-[4-(4-methylphenyl)piperidin-1-yl]-2-phenylquinoxaline-6-carboxylate;3-[4-(4-methylphenyl)piperidin-1-yl]-2-phenylquinoxaline-6-carboxylic acid;pyridin-4-ylboronic acid;4-[4-(trifluoromethyl)phenyl]piperidine;4-[4-(trifluoromethyl)phenyl]pyridine.
What is the SMILES notation for 1-bromo-4-(trifluoromethyl)benzene;methyl 3-[4-(4-methylphenyl)piperidin-1-yl]-2-phenylquinoxaline-6-carboxylate;3-[4-(4-methylphenyl)piperidin-1-yl]-2-phenylquinoxaline-6-carboxylic acid;pyridin-4-ylboronic acid;4-[4-(trifluoromethyl)phenyl]piperidine;4-[4-(trifluoromethyl)phenyl]pyridine?
The canonical SMILES for 1-bromo-4-(trifluoromethyl)benzene;methyl 3-[4-(4-methylphenyl)piperidin-1-yl]-2-phenylquinoxaline-6-carboxylate;3-[4-(4-methylphenyl)piperidin-1-yl]-2-phenylquinoxaline-6-carboxylic acid;pyridin-4-ylboronic acid;4-[4-(trifluoromethyl)phenyl]piperidine;4-[4-(trifluoromethyl)phenyl]pyridine is COC(=O)c1ccc2nc(-c3ccccc3)c(N3CCC(c4ccc(C)cc4)CC3)nc2c1.Cc1ccc(C2CCN(c3nc4cc(C(=O)O)ccc4nc3-c3ccccc3)CC2)cc1.FC(F)(F)c1ccc(-c2ccncc2)cc1.FC(F)(F)c1ccc(Br)cc1.FC(F)(F)c1ccc(C2CCNCC2)cc1.OB(O)c1ccncc1.
What is the InChIKey of 1-bromo-4-(trifluoromethyl)benzene;methyl 3-[4-(4-methylphenyl)piperidin-1-yl]-2-phenylquinoxaline-6-carboxylate;3-[4-(4-methylphenyl)piperidin-1-yl]-2-phenylquinoxaline-6-carboxylic acid;pyridin-4-ylboronic acid;4-[4-(trifluoromethyl)phenyl]piperidine;4-[4-(trifluoromethyl)phenyl]pyridine?
The InChIKey is ZSPDGUHYYZSYRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H27N3O2.C27H25N3O2.C12H14F3N.C12H8F3N.C7H4BrF3.C5H6BNO2/c1-19-8-10-20(11-9-19)21-14-16-31(17-15-21)27-26(22-6-4-3-5-7-22)29-24-13-12-23(28(32)33-2)18-25(24)30-27;1-18-7-9-19(10-8-18)20-13-15-30(16-14-20)26-25(21-5-3-2-4-6-21)28-23-12-11-22(27(31)32)17-24(23)29-26;2*13-12(14,15)11-3-1-9(2-4-11)10-5-7-16-8-6-10;8-6-3-1-5(2-4-6)7(9,10)11;8-6(9)5-1-3-7-4-2-5/h3-13,18,21H,14-17H2,1-2H3;2-12,17,20H,13-16H2,1H3,(H,31,32);1-4,10,16H,5-8H2;1-8H;1-4H;1-4,8-9H.
What are the key properties of 1-bromo-4-(trifluoromethyl)benzene;methyl 3-[4-(4-methylphenyl)piperidin-1-yl]-2-phenylquinoxaline-6-carboxylate;3-[4-(4-methylphenyl)piperidin-1-yl]-2-phenylquinoxaline-6-carboxylic acid;pyridin-4-ylboronic acid;4-[4-(trifluoromethyl)phenyl]piperidine;4-[4-(trifluoromethyl)phenyl]pyridine?
1-bromo-4-(trifluoromethyl)benzene;methyl 3-[4-(4-methylphenyl)piperidin-1-yl]-2-phenylquinoxaline-6-carboxylate;3-[4-(4-methylphenyl)piperidin-1-yl]-2-phenylquinoxaline-6-carboxylic acid;pyridin-4-ylboronic acid;4-[4-(trifluoromethyl)phenyl]piperidine;4-[4-(trifluoromethyl)phenyl]pyridine has a molecular weight of 1661.43 g/mol, XLogP of 20.63, 11 rotatable bonds, 4 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for 1-bromo-4-(trifluoromethyl)benzene;methyl 3-[4-(4-methylphenyl)piperidin-1-yl]-2-phenylquinoxaline-6-carboxylate;3-[4-(4-methylphenyl)piperidin-1-yl]-2-phenylquinoxaline-6-carboxylic acid;pyridin-4-ylboronic acid;4-[4-(trifluoromethyl)phenyl]piperidine;4-[4-(trifluoromethyl)phenyl]pyridine is sourced from PubChem (CID 162209070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).