About bis(tert-butyl 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate);pentakis(3,4-dimethyloxolane-2,5-dione);(1-ethylcyclohexyl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;(3-hydroxy-1-adamantyl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;(2-methyl-2-adamantyl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;2-methylbutan-2-yl 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;2-(4-methyl-2-oxocyclohexyl)propan-2-yl 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;(2-methyl-4-oxopentan-2-yl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;(5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;(2-oxooxolan-3-yl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate
bis(tert-butyl 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate);pentakis(3,4-dimethyloxolane-2,5-dione);(1-ethylcyclohexyl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;(3-hydroxy-1-adamantyl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;(2-methyl-2-adamantyl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;2-methylbutan-2-yl 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;2-(4-methyl-2-oxocyclohexyl)propan-2-yl 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;(2-methyl-4-oxopentan-2-yl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;(5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;(2-oxooxolan-3-yl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate (PubChem CID 162059861) has the molecular formula C200H308O42
and a molecular weight of 3384.62 g/mol. Its IUPAC name is bis(tert-butyl 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate);pentakis(3,4-dimethyloxolane-2,5-dione);(1-ethylcyclohexyl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;(3-hydroxy-1-adamantyl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;(2-methyl-2-adamantyl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;2-methylbutan-2-yl 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;2-(4-methyl-2-oxocyclohexyl)propan-2-yl 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;(2-methyl-4-oxopentan-2-yl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;(5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;(2-oxooxolan-3-yl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate.
Frequently Asked Questions
What is the IUPAC name of bis(tert-butyl 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate);pentakis(3,4-dimethyloxolane-2,5-dione);(1-ethylcyclohexyl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;(3-hydroxy-1-adamantyl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;(2-methyl-2-adamantyl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;2-methylbutan-2-yl 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;2-(4-methyl-2-oxocyclohexyl)propan-2-yl 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;(2-methyl-4-oxopentan-2-yl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;(5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;(2-oxooxolan-3-yl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate?
The IUPAC name of bis(tert-butyl 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate);pentakis(3,4-dimethyloxolane-2,5-dione);(1-ethylcyclohexyl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;(3-hydroxy-1-adamantyl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;(2-methyl-2-adamantyl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;2-methylbutan-2-yl 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;2-(4-methyl-2-oxocyclohexyl)propan-2-yl 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;(2-methyl-4-oxopentan-2-yl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;(5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;(2-oxooxolan-3-yl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate (CID 162059861) is bis(tert-butyl 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate);pentakis(3,4-dimethyloxolane-2,5-dione);(1-ethylcyclohexyl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;(3-hydroxy-1-adamantyl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;(2-methyl-2-adamantyl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;2-methylbutan-2-yl 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;2-(4-methyl-2-oxocyclohexyl)propan-2-yl 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;(2-methyl-4-oxopentan-2-yl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;(5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;(2-oxooxolan-3-yl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate.
What is the SMILES notation for bis(tert-butyl 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate);pentakis(3,4-dimethyloxolane-2,5-dione);(1-ethylcyclohexyl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;(3-hydroxy-1-adamantyl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;(2-methyl-2-adamantyl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;2-methylbutan-2-yl 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;2-(4-methyl-2-oxocyclohexyl)propan-2-yl 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;(2-methyl-4-oxopentan-2-yl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;(5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;(2-oxooxolan-3-yl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate?
The canonical SMILES for bis(tert-butyl 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate);pentakis(3,4-dimethyloxolane-2,5-dione);(1-ethylcyclohexyl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;(3-hydroxy-1-adamantyl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;(2-methyl-2-adamantyl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;2-methylbutan-2-yl 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;2-(4-methyl-2-oxocyclohexyl)propan-2-yl 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;(2-methyl-4-oxopentan-2-yl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;(5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;(2-oxooxolan-3-yl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate is CC(=O)CC(C)(C)OC(=O)C1CC2CC1C(C)C2C.CC1C(=O)OC(=O)C1C.CC1C(=O)OC(=O)C1C.CC1C(=O)OC(=O)C1C.CC1C(=O)OC(=O)C1C.CC1C(=O)OC(=O)C1C.CC1C2CC(C(=O)OC(C)(C)C)C(C2)C1C.CC1C2CC(C(=O)OC(C)(C)C)C(C2)C1C.CC1C2CC(C(=O)OC3(C)C4CC5CC(C4)CC3C5)C(C2)C1C.CC1C2CC(C(=O)OC34CC5CC(CC(O)(C5)C3)C4)C(C2)C1C.CC1C2CC(C(=O)OC3C4CC5C(=O)OC3C5C4)C(C2)C1C.CC1C2CC(C(=O)OC3CCOC3=O)C(C2)C1C.CC1CCC(C(C)(C)OC(=O)C2CC3CC2C(C)C3C)C(=O)C1.CCC(C)(C)OC(=O)C1CC2CC1C(C)C2C.CCC1(OC(=O)C2CC3CC2C(C)C3C)CCCCC1.
What is the InChIKey of bis(tert-butyl 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate);pentakis(3,4-dimethyloxolane-2,5-dione);(1-ethylcyclohexyl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;(3-hydroxy-1-adamantyl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;(2-methyl-2-adamantyl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;2-methylbutan-2-yl 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;2-(4-methyl-2-oxocyclohexyl)propan-2-yl 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;(2-methyl-4-oxopentan-2-yl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;(5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;(2-oxooxolan-3-yl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate?
The InChIKey is YZRLNNWHSBDQSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H32O2.C20H30O3.C20H32O3.C18H24O4.C18H30O2.C16H26O3.C15H26O2.C14H20O4.2C14H24O2.5C6H8O3/c1-11-12(2)18-9-15(11)10-19(18)20(22)23-21(3)16-5-13-4-14(7-16)8-17(21)6-13;1-11-12(2)16-4-15(11)5-17(16)18(21)23-20-8-13-3-14(9-20)7-19(22,6-13)10-20;1-11-6-7-17(18(21)8-11)20(4,5)23-19(22)16-10-14-9-15(16)13(3)12(14)2;1-7-8(2)11-3-9(7)4-13(11)17(19)21-15-10-5-12-14(6-10)18(20)22-16(12)15;1-4-18(8-6-5-7-9-18)20-17(19)16-11-14-10-15(16)13(3)12(14)2;1-9(17)8-16(4,5)19-15(18)14-7-12-6-13(14)11(3)10(12)2;1-6-15(4,5)17-14(16)13-8-11-7-12(13)10(3)9(11)2;1-7-8(2)10-5-9(7)6-11(10)13(15)18-12-3-4-17-14(12)16;2*1-8-9(2)11-6-10(8)7-12(11)13(15)16-14(3,4)5;5*1-3-4(2)6(8)9-5(3)7/h11-19H,4-10H2,1-3H3;11-17,22H,3-10H2,1-2H3;11-17H,6-10H2,1-5H3;7-16H,3-6H2,1-2H3;12-16H,4-11H2,1-3H3;10-14H,6-8H2,1-5H3;9-13H,6-8H2,1-5H3;7-12H,3-6H2,1-2H3;2*8-12H,6-7H2,1-5H3;5*3-4H,1-2H3.
What are the key properties of bis(tert-butyl 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate);pentakis(3,4-dimethyloxolane-2,5-dione);(1-ethylcyclohexyl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;(3-hydroxy-1-adamantyl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;(2-methyl-2-adamantyl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;2-methylbutan-2-yl 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;2-(4-methyl-2-oxocyclohexyl)propan-2-yl 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;(2-methyl-4-oxopentan-2-yl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;(5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;(2-oxooxolan-3-yl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate?
bis(tert-butyl 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate);pentakis(3,4-dimethyloxolane-2,5-dione);(1-ethylcyclohexyl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;(3-hydroxy-1-adamantyl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;(2-methyl-2-adamantyl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;2-methylbutan-2-yl 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;2-(4-methyl-2-oxocyclohexyl)propan-2-yl 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;(2-methyl-4-oxopentan-2-yl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;(5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;(2-oxooxolan-3-yl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate has a molecular weight of 3384.62 g/mol, XLogP of 36.29, 23 rotatable bonds, 1 hydrogen bond donors, and 42 hydrogen bond acceptors.
Where does this data come from?
All data for bis(tert-butyl 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate);pentakis(3,4-dimethyloxolane-2,5-dione);(1-ethylcyclohexyl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;(3-hydroxy-1-adamantyl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;(2-methyl-2-adamantyl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;2-methylbutan-2-yl 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;2-(4-methyl-2-oxocyclohexyl)propan-2-yl 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;(2-methyl-4-oxopentan-2-yl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;(5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate;(2-oxooxolan-3-yl) 5,6-dimethylbicyclo[2.2.1]heptane-2-carboxylate is sourced from PubChem (CID 162059861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).