About [2-[(2-ethyl-2-adamantyl)oxy]-2-oxoethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;(5-hydroxy-2-adamantyl) 2,2-difluoro-2-oxidoperoxysulfanylacetate;2-[(3-hydroxy-1-adamantyl)oxy]ethyl 2,3,3,3-tetrafluoro-2-oxidoperoxysulfanylpropanoate;[2-[(3-hydroxy-1-adamantyl)oxy]-2-oxoethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[2-[(4-hydroxy-1-adamantyl)oxy]-2-oxoethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[2-[(2-methyl-2-adamantyl)oxy]-2-oxoethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[4-(4-methylphenyl)cyclohexyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[4-[(4-methylphenyl)methyl]-8-tricyclo[5.2.1.02,6]decanyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[2-oxo-2-[(4-oxo-1-adamantyl)oxy]ethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[2-oxo-2-[(5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl)oxy]ethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate
[2-[(2-ethyl-2-adamantyl)oxy]-2-oxoethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;(5-hydroxy-2-adamantyl) 2,2-difluoro-2-oxidoperoxysulfanylacetate;2-[(3-hydroxy-1-adamantyl)oxy]ethyl 2,3,3,3-tetrafluoro-2-oxidoperoxysulfanylpropanoate;[2-[(3-hydroxy-1-adamantyl)oxy]-2-oxoethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[2-[(4-hydroxy-1-adamantyl)oxy]-2-oxoethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[2-[(2-methyl-2-adamantyl)oxy]-2-oxoethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[4-(4-methylphenyl)cyclohexyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[4-[(4-methylphenyl)methyl]-8-tricyclo[5.2.1.02,6]decanyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[2-oxo-2-[(4-oxo-1-adamantyl)oxy]ethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[2-oxo-2-[(5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl)oxy]ethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate (PubChem CID 165096840) has the molecular formula C147H174F22O70S10-10
and a molecular weight of 3799.56 g/mol. Its IUPAC name is [2-[(2-ethyl-2-adamantyl)oxy]-2-oxoethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;(5-hydroxy-2-adamantyl) 2,2-difluoro-2-oxidoperoxysulfanylacetate;2-[(3-hydroxy-1-adamantyl)oxy]ethyl 2,3,3,3-tetrafluoro-2-oxidoperoxysulfanylpropanoate;[2-[(3-hydroxy-1-adamantyl)oxy]-2-oxoethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[2-[(4-hydroxy-1-adamantyl)oxy]-2-oxoethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[2-[(2-methyl-2-adamantyl)oxy]-2-oxoethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[4-(4-methylphenyl)cyclohexyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[4-[(4-methylphenyl)methyl]-8-tricyclo[5.2.1.02,6]decanyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[2-oxo-2-[(4-oxo-1-adamantyl)oxy]ethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[2-oxo-2-[(5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl)oxy]ethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate.
Frequently Asked Questions
What is the IUPAC name of [2-[(2-ethyl-2-adamantyl)oxy]-2-oxoethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;(5-hydroxy-2-adamantyl) 2,2-difluoro-2-oxidoperoxysulfanylacetate;2-[(3-hydroxy-1-adamantyl)oxy]ethyl 2,3,3,3-tetrafluoro-2-oxidoperoxysulfanylpropanoate;[2-[(3-hydroxy-1-adamantyl)oxy]-2-oxoethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[2-[(4-hydroxy-1-adamantyl)oxy]-2-oxoethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[2-[(2-methyl-2-adamantyl)oxy]-2-oxoethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[4-(4-methylphenyl)cyclohexyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[4-[(4-methylphenyl)methyl]-8-tricyclo[5.2.1.02,6]decanyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[2-oxo-2-[(4-oxo-1-adamantyl)oxy]ethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[2-oxo-2-[(5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl)oxy]ethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate?
The IUPAC name of [2-[(2-ethyl-2-adamantyl)oxy]-2-oxoethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;(5-hydroxy-2-adamantyl) 2,2-difluoro-2-oxidoperoxysulfanylacetate;2-[(3-hydroxy-1-adamantyl)oxy]ethyl 2,3,3,3-tetrafluoro-2-oxidoperoxysulfanylpropanoate;[2-[(3-hydroxy-1-adamantyl)oxy]-2-oxoethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[2-[(4-hydroxy-1-adamantyl)oxy]-2-oxoethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[2-[(2-methyl-2-adamantyl)oxy]-2-oxoethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[4-(4-methylphenyl)cyclohexyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[4-[(4-methylphenyl)methyl]-8-tricyclo[5.2.1.02,6]decanyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[2-oxo-2-[(4-oxo-1-adamantyl)oxy]ethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[2-oxo-2-[(5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl)oxy]ethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate (CID 165096840) is [2-[(2-ethyl-2-adamantyl)oxy]-2-oxoethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;(5-hydroxy-2-adamantyl) 2,2-difluoro-2-oxidoperoxysulfanylacetate;2-[(3-hydroxy-1-adamantyl)oxy]ethyl 2,3,3,3-tetrafluoro-2-oxidoperoxysulfanylpropanoate;[2-[(3-hydroxy-1-adamantyl)oxy]-2-oxoethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[2-[(4-hydroxy-1-adamantyl)oxy]-2-oxoethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[2-[(2-methyl-2-adamantyl)oxy]-2-oxoethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[4-(4-methylphenyl)cyclohexyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[4-[(4-methylphenyl)methyl]-8-tricyclo[5.2.1.02,6]decanyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[2-oxo-2-[(4-oxo-1-adamantyl)oxy]ethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[2-oxo-2-[(5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl)oxy]ethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate.
What is the SMILES notation for [2-[(2-ethyl-2-adamantyl)oxy]-2-oxoethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;(5-hydroxy-2-adamantyl) 2,2-difluoro-2-oxidoperoxysulfanylacetate;2-[(3-hydroxy-1-adamantyl)oxy]ethyl 2,3,3,3-tetrafluoro-2-oxidoperoxysulfanylpropanoate;[2-[(3-hydroxy-1-adamantyl)oxy]-2-oxoethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[2-[(4-hydroxy-1-adamantyl)oxy]-2-oxoethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[2-[(2-methyl-2-adamantyl)oxy]-2-oxoethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[4-(4-methylphenyl)cyclohexyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[4-[(4-methylphenyl)methyl]-8-tricyclo[5.2.1.02,6]decanyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[2-oxo-2-[(4-oxo-1-adamantyl)oxy]ethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[2-oxo-2-[(5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl)oxy]ethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate?
The canonical SMILES for [2-[(2-ethyl-2-adamantyl)oxy]-2-oxoethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;(5-hydroxy-2-adamantyl) 2,2-difluoro-2-oxidoperoxysulfanylacetate;2-[(3-hydroxy-1-adamantyl)oxy]ethyl 2,3,3,3-tetrafluoro-2-oxidoperoxysulfanylpropanoate;[2-[(3-hydroxy-1-adamantyl)oxy]-2-oxoethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[2-[(4-hydroxy-1-adamantyl)oxy]-2-oxoethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[2-[(2-methyl-2-adamantyl)oxy]-2-oxoethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[4-(4-methylphenyl)cyclohexyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[4-[(4-methylphenyl)methyl]-8-tricyclo[5.2.1.02,6]decanyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[2-oxo-2-[(4-oxo-1-adamantyl)oxy]ethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[2-oxo-2-[(5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl)oxy]ethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate is CC1(OC(=O)COC(=O)C(F)(F)SOO[O-])C2CC3CC(C2)CC1C3.CCC1(OC(=O)COC(=O)C(F)(F)SOO[O-])C2CC3CC(C2)CC1C3.Cc1ccc(C2CCC(OC(=O)C(F)(F)SOO[O-])CC2)cc1.Cc1ccc(CC2CC3C4CC(OC(=O)C(F)(F)SOO[O-])C(C4)C3C2)cc1.O=C(COC(=O)C(F)(F)SOO[O-])OC12CC3CC(C1)C(=O)C(C3)C2.O=C(COC(=O)C(F)(F)SOO[O-])OC12CC3CC(C1)C(O)C(C3)C2.O=C(COC(=O)C(F)(F)SOO[O-])OC12CC3CC(CC(O)(C3)C1)C2.O=C(COC(=O)C(F)(F)SOO[O-])OC1C2CC3C(=O)OC1C3C2.O=C(OC1C2CC3CC1CC(O)(C3)C2)C(F)(F)SOO[O-].O=C(OCCOC12CC3CC(CC(O)(C3)C1)C2)C(F)(SOO[O-])C(F)(F)F.
What is the InChIKey of [2-[(2-ethyl-2-adamantyl)oxy]-2-oxoethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;(5-hydroxy-2-adamantyl) 2,2-difluoro-2-oxidoperoxysulfanylacetate;2-[(3-hydroxy-1-adamantyl)oxy]ethyl 2,3,3,3-tetrafluoro-2-oxidoperoxysulfanylpropanoate;[2-[(3-hydroxy-1-adamantyl)oxy]-2-oxoethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[2-[(4-hydroxy-1-adamantyl)oxy]-2-oxoethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[2-[(2-methyl-2-adamantyl)oxy]-2-oxoethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[4-(4-methylphenyl)cyclohexyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[4-[(4-methylphenyl)methyl]-8-tricyclo[5.2.1.02,6]decanyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[2-oxo-2-[(4-oxo-1-adamantyl)oxy]ethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[2-oxo-2-[(5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl)oxy]ethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate?
The InChIKey is XQRWHWXPDUMKHM-UHFFFAOYSA-D. The full InChI is InChI=1S/C20H24F2O5S.C16H22F2O7S.C15H20F4O7S.C15H20F2O7S.C15H18F2O5S.2C14H18F2O8S.C14H16F2O8S.C12H12F2O9S.C12H16F2O6S/c1-11-2-4-12(5-3-11)6-13-7-15-14-9-17(16(15)8-13)18(10-14)25-19(23)20(21,22)28-27-26-24;1-2-15(11-4-9-3-10(6-11)7-12(15)5-9)23-13(19)8-22-14(20)16(17,18)26-25-24-21;16-14(15(17,18)19,27-26-25-22)11(20)23-1-2-24-13-6-9-3-10(7-13)5-12(21,4-9)8-13;1-14(10-3-8-2-9(5-10)6-11(14)4-8)22-12(18)7-21-13(19)15(16,17)25-24-23-20;1-10-2-4-11(5-3-10)12-6-8-13(9-7-12)20-14(18)15(16,17)23-22-21-19;15-14(16,25-24-23-20)11(18)21-6-10(17)22-13-4-8-1-9(5-13)3-12(19,2-8)7-13;2*15-14(16,25-24-23-20)12(19)21-6-10(17)22-13-3-7-1-8(4-13)11(18)9(2-7)5-13;13-12(14,24-23-22-18)11(17)19-3-7(15)20-8-4-1-5-6(2-4)10(16)21-9(5)8;13-12(14,21-20-19-17)10(15)18-9-7-1-6-2-8(9)5-11(16,3-6)4-7/h2-5,13-18,24H,6-10H2,1H3;9-12,21H,2-8H2,1H3;9-10,21-22H,1-8H2;8-11,20H,2-7H2,1H3;2-5,12-13,19H,6-9H2,1H3;8-9,19-20H,1-7H2;7-9,11,18,20H,1-6H2;7-9,20H,1-6H2;4-6,8-9,18H,1-3H2;6-9,16-17H,1-5H2/p-10.
What are the key properties of [2-[(2-ethyl-2-adamantyl)oxy]-2-oxoethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;(5-hydroxy-2-adamantyl) 2,2-difluoro-2-oxidoperoxysulfanylacetate;2-[(3-hydroxy-1-adamantyl)oxy]ethyl 2,3,3,3-tetrafluoro-2-oxidoperoxysulfanylpropanoate;[2-[(3-hydroxy-1-adamantyl)oxy]-2-oxoethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[2-[(4-hydroxy-1-adamantyl)oxy]-2-oxoethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[2-[(2-methyl-2-adamantyl)oxy]-2-oxoethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[4-(4-methylphenyl)cyclohexyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[4-[(4-methylphenyl)methyl]-8-tricyclo[5.2.1.02,6]decanyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[2-oxo-2-[(4-oxo-1-adamantyl)oxy]ethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[2-oxo-2-[(5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl)oxy]ethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate?
[2-[(2-ethyl-2-adamantyl)oxy]-2-oxoethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;(5-hydroxy-2-adamantyl) 2,2-difluoro-2-oxidoperoxysulfanylacetate;2-[(3-hydroxy-1-adamantyl)oxy]ethyl 2,3,3,3-tetrafluoro-2-oxidoperoxysulfanylpropanoate;[2-[(3-hydroxy-1-adamantyl)oxy]-2-oxoethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[2-[(4-hydroxy-1-adamantyl)oxy]-2-oxoethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[2-[(2-methyl-2-adamantyl)oxy]-2-oxoethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[4-(4-methylphenyl)cyclohexyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[4-[(4-methylphenyl)methyl]-8-tricyclo[5.2.1.02,6]decanyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[2-oxo-2-[(4-oxo-1-adamantyl)oxy]ethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[2-oxo-2-[(5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl)oxy]ethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate has a molecular weight of 3799.56 g/mol, XLogP of 14.45, 69 rotatable bonds, 4 hydrogen bond donors, and 80 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(2-ethyl-2-adamantyl)oxy]-2-oxoethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;(5-hydroxy-2-adamantyl) 2,2-difluoro-2-oxidoperoxysulfanylacetate;2-[(3-hydroxy-1-adamantyl)oxy]ethyl 2,3,3,3-tetrafluoro-2-oxidoperoxysulfanylpropanoate;[2-[(3-hydroxy-1-adamantyl)oxy]-2-oxoethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[2-[(4-hydroxy-1-adamantyl)oxy]-2-oxoethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[2-[(2-methyl-2-adamantyl)oxy]-2-oxoethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[4-(4-methylphenyl)cyclohexyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[4-[(4-methylphenyl)methyl]-8-tricyclo[5.2.1.02,6]decanyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[2-oxo-2-[(4-oxo-1-adamantyl)oxy]ethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate;[2-oxo-2-[(5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl)oxy]ethyl] 2,2-difluoro-2-oxidoperoxysulfanylacetate is sourced from PubChem (CID 165096840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).