About 1-butan-2-yl-4-[1-(2-cyclohexylethoxy)ethoxy]benzene;1-butan-2-yl-4-(1-cyclohexyloxy-3,3-dimethylbutoxy)benzene;1-butan-2-yl-4-(2-methylbutan-2-yloxy)benzene;heptakis(4-butan-2-ylphenol);1-[(4-butan-2-ylphenoxy)-ethoxymethyl]adamantane;tert-butyl 2-(4-butan-2-ylphenoxy)acetate;(1-cyclohexyloxy-2,2-dimethylpropyl) 2,2-dimethylbutanoate;3-cyclohexylpentan-3-yl 2,2-dimethylbutanoate;(3,5-dihydroxy-1-adamantyl) 2,2-dimethylbutanoate;1,2-dimethyl-1,2-dihydroacenaphthylene;(4-hydroxyphenyl) 2,2-dimethylbutanoate;bis((5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2,2-dimethylbutanoate);1-phenylethyl 2,2-dimethylbutanoate;(4-phenylphenyl) 2,2-dimethylbutanoate
1-butan-2-yl-4-[1-(2-cyclohexylethoxy)ethoxy]benzene;1-butan-2-yl-4-(1-cyclohexyloxy-3,3-dimethylbutoxy)benzene;1-butan-2-yl-4-(2-methylbutan-2-yloxy)benzene;heptakis(4-butan-2-ylphenol);1-[(4-butan-2-ylphenoxy)-ethoxymethyl]adamantane;tert-butyl 2-(4-butan-2-ylphenoxy)acetate;(1-cyclohexyloxy-2,2-dimethylpropyl) 2,2-dimethylbutanoate;3-cyclohexylpentan-3-yl 2,2-dimethylbutanoate;(3,5-dihydroxy-1-adamantyl) 2,2-dimethylbutanoate;1,2-dimethyl-1,2-dihydroacenaphthylene;(4-hydroxyphenyl) 2,2-dimethylbutanoate;bis((5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2,2-dimethylbutanoate);1-phenylethyl 2,2-dimethylbutanoate;(4-phenylphenyl) 2,2-dimethylbutanoate (PubChem CID 157304916) has the molecular formula C302H448O41
and a molecular weight of 4734.86 g/mol. Its IUPAC name is 1-butan-2-yl-4-[1-(2-cyclohexylethoxy)ethoxy]benzene;1-butan-2-yl-4-(1-cyclohexyloxy-3,3-dimethylbutoxy)benzene;1-butan-2-yl-4-(2-methylbutan-2-yloxy)benzene;heptakis(4-butan-2-ylphenol);1-[(4-butan-2-ylphenoxy)-ethoxymethyl]adamantane;tert-butyl 2-(4-butan-2-ylphenoxy)acetate;(1-cyclohexyloxy-2,2-dimethylpropyl) 2,2-dimethylbutanoate;3-cyclohexylpentan-3-yl 2,2-dimethylbutanoate;(3,5-dihydroxy-1-adamantyl) 2,2-dimethylbutanoate;1,2-dimethyl-1,2-dihydroacenaphthylene;(4-hydroxyphenyl) 2,2-dimethylbutanoate;bis((5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2,2-dimethylbutanoate);1-phenylethyl 2,2-dimethylbutanoate;(4-phenylphenyl) 2,2-dimethylbutanoate.
Frequently Asked Questions
What is the IUPAC name of 1-butan-2-yl-4-[1-(2-cyclohexylethoxy)ethoxy]benzene;1-butan-2-yl-4-(1-cyclohexyloxy-3,3-dimethylbutoxy)benzene;1-butan-2-yl-4-(2-methylbutan-2-yloxy)benzene;heptakis(4-butan-2-ylphenol);1-[(4-butan-2-ylphenoxy)-ethoxymethyl]adamantane;tert-butyl 2-(4-butan-2-ylphenoxy)acetate;(1-cyclohexyloxy-2,2-dimethylpropyl) 2,2-dimethylbutanoate;3-cyclohexylpentan-3-yl 2,2-dimethylbutanoate;(3,5-dihydroxy-1-adamantyl) 2,2-dimethylbutanoate;1,2-dimethyl-1,2-dihydroacenaphthylene;(4-hydroxyphenyl) 2,2-dimethylbutanoate;bis((5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2,2-dimethylbutanoate);1-phenylethyl 2,2-dimethylbutanoate;(4-phenylphenyl) 2,2-dimethylbutanoate?
The IUPAC name of 1-butan-2-yl-4-[1-(2-cyclohexylethoxy)ethoxy]benzene;1-butan-2-yl-4-(1-cyclohexyloxy-3,3-dimethylbutoxy)benzene;1-butan-2-yl-4-(2-methylbutan-2-yloxy)benzene;heptakis(4-butan-2-ylphenol);1-[(4-butan-2-ylphenoxy)-ethoxymethyl]adamantane;tert-butyl 2-(4-butan-2-ylphenoxy)acetate;(1-cyclohexyloxy-2,2-dimethylpropyl) 2,2-dimethylbutanoate;3-cyclohexylpentan-3-yl 2,2-dimethylbutanoate;(3,5-dihydroxy-1-adamantyl) 2,2-dimethylbutanoate;1,2-dimethyl-1,2-dihydroacenaphthylene;(4-hydroxyphenyl) 2,2-dimethylbutanoate;bis((5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2,2-dimethylbutanoate);1-phenylethyl 2,2-dimethylbutanoate;(4-phenylphenyl) 2,2-dimethylbutanoate (CID 157304916) is 1-butan-2-yl-4-[1-(2-cyclohexylethoxy)ethoxy]benzene;1-butan-2-yl-4-(1-cyclohexyloxy-3,3-dimethylbutoxy)benzene;1-butan-2-yl-4-(2-methylbutan-2-yloxy)benzene;heptakis(4-butan-2-ylphenol);1-[(4-butan-2-ylphenoxy)-ethoxymethyl]adamantane;tert-butyl 2-(4-butan-2-ylphenoxy)acetate;(1-cyclohexyloxy-2,2-dimethylpropyl) 2,2-dimethylbutanoate;3-cyclohexylpentan-3-yl 2,2-dimethylbutanoate;(3,5-dihydroxy-1-adamantyl) 2,2-dimethylbutanoate;1,2-dimethyl-1,2-dihydroacenaphthylene;(4-hydroxyphenyl) 2,2-dimethylbutanoate;bis((5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2,2-dimethylbutanoate);1-phenylethyl 2,2-dimethylbutanoate;(4-phenylphenyl) 2,2-dimethylbutanoate.
What is the SMILES notation for 1-butan-2-yl-4-[1-(2-cyclohexylethoxy)ethoxy]benzene;1-butan-2-yl-4-(1-cyclohexyloxy-3,3-dimethylbutoxy)benzene;1-butan-2-yl-4-(2-methylbutan-2-yloxy)benzene;heptakis(4-butan-2-ylphenol);1-[(4-butan-2-ylphenoxy)-ethoxymethyl]adamantane;tert-butyl 2-(4-butan-2-ylphenoxy)acetate;(1-cyclohexyloxy-2,2-dimethylpropyl) 2,2-dimethylbutanoate;3-cyclohexylpentan-3-yl 2,2-dimethylbutanoate;(3,5-dihydroxy-1-adamantyl) 2,2-dimethylbutanoate;1,2-dimethyl-1,2-dihydroacenaphthylene;(4-hydroxyphenyl) 2,2-dimethylbutanoate;bis((5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2,2-dimethylbutanoate);1-phenylethyl 2,2-dimethylbutanoate;(4-phenylphenyl) 2,2-dimethylbutanoate?
The canonical SMILES for 1-butan-2-yl-4-[1-(2-cyclohexylethoxy)ethoxy]benzene;1-butan-2-yl-4-(1-cyclohexyloxy-3,3-dimethylbutoxy)benzene;1-butan-2-yl-4-(2-methylbutan-2-yloxy)benzene;heptakis(4-butan-2-ylphenol);1-[(4-butan-2-ylphenoxy)-ethoxymethyl]adamantane;tert-butyl 2-(4-butan-2-ylphenoxy)acetate;(1-cyclohexyloxy-2,2-dimethylpropyl) 2,2-dimethylbutanoate;3-cyclohexylpentan-3-yl 2,2-dimethylbutanoate;(3,5-dihydroxy-1-adamantyl) 2,2-dimethylbutanoate;1,2-dimethyl-1,2-dihydroacenaphthylene;(4-hydroxyphenyl) 2,2-dimethylbutanoate;bis((5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2,2-dimethylbutanoate);1-phenylethyl 2,2-dimethylbutanoate;(4-phenylphenyl) 2,2-dimethylbutanoate is CC1c2cccc3cccc(c23)C1C.CCC(C)(C)C(=O)OC(C)c1ccccc1.CCC(C)(C)C(=O)OC(CC)(CC)C1CCCCC1.CCC(C)(C)C(=O)OC(OC1CCCCC1)C(C)(C)C.CCC(C)(C)C(=O)OC12CC3CC(O)(CC(O)(C3)C1)C2.CCC(C)(C)C(=O)OC1C2CC3C(=O)OC1C3C2.CCC(C)(C)C(=O)OC1C2CC3C(=O)OC1C3C2.CCC(C)(C)C(=O)Oc1ccc(-c2ccccc2)cc1.CCC(C)(C)C(=O)Oc1ccc(O)cc1.CCC(C)c1ccc(O)cc1.CCC(C)c1ccc(O)cc1.CCC(C)c1ccc(O)cc1.CCC(C)c1ccc(O)cc1.CCC(C)c1ccc(O)cc1.CCC(C)c1ccc(O)cc1.CCC(C)c1ccc(O)cc1.CCC(C)c1ccc(OC(C)(C)CC)cc1.CCC(C)c1ccc(OC(C)OCCC2CCCCC2)cc1.CCC(C)c1ccc(OC(CC(C)(C)C)OC2CCCCC2)cc1.CCC(C)c1ccc(OCC(=O)OC(C)(C)C)cc1.CCOC(Oc1ccc(C(C)CC)cc1)C12CC3CC(CC(C3)C1)C2.
What is the InChIKey of 1-butan-2-yl-4-[1-(2-cyclohexylethoxy)ethoxy]benzene;1-butan-2-yl-4-(1-cyclohexyloxy-3,3-dimethylbutoxy)benzene;1-butan-2-yl-4-(2-methylbutan-2-yloxy)benzene;heptakis(4-butan-2-ylphenol);1-[(4-butan-2-ylphenoxy)-ethoxymethyl]adamantane;tert-butyl 2-(4-butan-2-ylphenoxy)acetate;(1-cyclohexyloxy-2,2-dimethylpropyl) 2,2-dimethylbutanoate;3-cyclohexylpentan-3-yl 2,2-dimethylbutanoate;(3,5-dihydroxy-1-adamantyl) 2,2-dimethylbutanoate;1,2-dimethyl-1,2-dihydroacenaphthylene;(4-hydroxyphenyl) 2,2-dimethylbutanoate;bis((5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2,2-dimethylbutanoate);1-phenylethyl 2,2-dimethylbutanoate;(4-phenylphenyl) 2,2-dimethylbutanoate?
The InChIKey is BCIQAEDBMMXFSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H34O2.C22H36O2.C20H32O2.C18H20O2.C17H32O3.C17H32O2.C16H26O4.C16H24O3.C15H24O.2C14H20O4.C14H20O2.C14H14.C12H16O3.7C10H14O/c1-4-16(3)20-6-8-21(9-7-20)25-22(24-5-2)23-13-17-10-18(14-23)12-19(11-17)15-23;1-6-17(2)18-12-14-20(15-13-18)24-21(16-22(3,4)5)23-19-10-8-7-9-11-19;1-4-16(2)19-10-12-20(13-11-19)22-17(3)21-15-14-18-8-6-5-7-9-18;1-4-18(2,3)17(19)20-16-12-10-15(11-13-16)14-8-6-5-7-9-14;1-7-17(5,6)14(18)20-15(16(2,3)4)19-13-11-9-8-10-12-13;1-6-16(4,5)15(18)19-17(7-2,8-3)14-12-10-9-11-13-14;1-4-13(2,3)12(17)20-16-7-11-5-14(18,9-16)8-15(19,6-11)10-16;1-6-12(2)13-7-9-14(10-8-13)18-11-15(17)19-16(3,4)5;1-6-12(3)13-8-10-14(11-9-13)16-15(4,5)7-2;2*1-4-14(2,3)13(16)18-10-7-5-8-9(6-7)12(15)17-11(8)10;1-5-14(3,4)13(15)16-11(2)12-9-7-6-8-10-12;1-9-10(2)13-8-4-6-11-5-3-7-12(9)14(11)13;1-4-12(2,3)11(14)15-10-7-5-9(13)6-8-10;7*1-3-8(2)9-4-6-10(11)7-5-9/h6-9,16-19,22H,4-5,10-15H2,1-3H3;12-15,17,19,21H,6-11,16H2,1-5H3;10-13,16-18H,4-9,14-15H2,1-3H3;5-13H,4H2,1-3H3;13,15H,7-12H2,1-6H3;14H,6-13H2,1-5H3;11,18-19H,4-10H2,1-3H3;7-10,12H,6,11H2,1-5H3;8-12H,6-7H2,1-5H3;2*7-11H,4-6H2,1-3H3;6-11H,5H2,1-4H3;3-10H,1-2H3;5-8,13H,4H2,1-3H3;7*4-8,11H,3H2,1-2H3.
What are the key properties of 1-butan-2-yl-4-[1-(2-cyclohexylethoxy)ethoxy]benzene;1-butan-2-yl-4-(1-cyclohexyloxy-3,3-dimethylbutoxy)benzene;1-butan-2-yl-4-(2-methylbutan-2-yloxy)benzene;heptakis(4-butan-2-ylphenol);1-[(4-butan-2-ylphenoxy)-ethoxymethyl]adamantane;tert-butyl 2-(4-butan-2-ylphenoxy)acetate;(1-cyclohexyloxy-2,2-dimethylpropyl) 2,2-dimethylbutanoate;3-cyclohexylpentan-3-yl 2,2-dimethylbutanoate;(3,5-dihydroxy-1-adamantyl) 2,2-dimethylbutanoate;1,2-dimethyl-1,2-dihydroacenaphthylene;(4-hydroxyphenyl) 2,2-dimethylbutanoate;bis((5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2,2-dimethylbutanoate);1-phenylethyl 2,2-dimethylbutanoate;(4-phenylphenyl) 2,2-dimethylbutanoate?
1-butan-2-yl-4-[1-(2-cyclohexylethoxy)ethoxy]benzene;1-butan-2-yl-4-(1-cyclohexyloxy-3,3-dimethylbutoxy)benzene;1-butan-2-yl-4-(2-methylbutan-2-yloxy)benzene;heptakis(4-butan-2-ylphenol);1-[(4-butan-2-ylphenoxy)-ethoxymethyl]adamantane;tert-butyl 2-(4-butan-2-ylphenoxy)acetate;(1-cyclohexyloxy-2,2-dimethylpropyl) 2,2-dimethylbutanoate;3-cyclohexylpentan-3-yl 2,2-dimethylbutanoate;(3,5-dihydroxy-1-adamantyl) 2,2-dimethylbutanoate;1,2-dimethyl-1,2-dihydroacenaphthylene;(4-hydroxyphenyl) 2,2-dimethylbutanoate;bis((5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2,2-dimethylbutanoate);1-phenylethyl 2,2-dimethylbutanoate;(4-phenylphenyl) 2,2-dimethylbutanoate has a molecular weight of 4734.86 g/mol, XLogP of 78.79, 77 rotatable bonds, 10 hydrogen bond donors, and 41 hydrogen bond acceptors.
Where does this data come from?
All data for 1-butan-2-yl-4-[1-(2-cyclohexylethoxy)ethoxy]benzene;1-butan-2-yl-4-(1-cyclohexyloxy-3,3-dimethylbutoxy)benzene;1-butan-2-yl-4-(2-methylbutan-2-yloxy)benzene;heptakis(4-butan-2-ylphenol);1-[(4-butan-2-ylphenoxy)-ethoxymethyl]adamantane;tert-butyl 2-(4-butan-2-ylphenoxy)acetate;(1-cyclohexyloxy-2,2-dimethylpropyl) 2,2-dimethylbutanoate;3-cyclohexylpentan-3-yl 2,2-dimethylbutanoate;(3,5-dihydroxy-1-adamantyl) 2,2-dimethylbutanoate;1,2-dimethyl-1,2-dihydroacenaphthylene;(4-hydroxyphenyl) 2,2-dimethylbutanoate;bis((5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2,2-dimethylbutanoate);1-phenylethyl 2,2-dimethylbutanoate;(4-phenylphenyl) 2,2-dimethylbutanoate is sourced from PubChem (CID 157304916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).