About 5-[2-(adamantane-1-carbonyloxy)-3-ethoxy-1,1,1-trifluoro-3-oxopropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate;5-[2-(adamantane-1-carbonyloxy)-1,1,1-trifluoro-3-(4-methylphenoxy)-3-oxopropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate;5-[2-(adamantane-1-carbonyloxy)-1,1,1-trifluoro-3-oxo-3-phenoxypropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate;5-[2-(adamantane-1-carbonyloxy)-1,1,1-trifluoro-3-oxo-3-phenylmethoxypropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate;5-[2-(adamantane-1-carbonyloxy)-1,1,1-trifluoro-3-oxo-3-propan-2-yloxypropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate;5-[2-(adamantane-1-carbonyloxy)-1,1,1-trifluoro-3-oxo-3-propoxypropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate
5-[2-(adamantane-1-carbonyloxy)-3-ethoxy-1,1,1-trifluoro-3-oxopropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate;5-[2-(adamantane-1-carbonyloxy)-1,1,1-trifluoro-3-(4-methylphenoxy)-3-oxopropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate;5-[2-(adamantane-1-carbonyloxy)-1,1,1-trifluoro-3-oxo-3-phenoxypropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate;5-[2-(adamantane-1-carbonyloxy)-1,1,1-trifluoro-3-oxo-3-phenylmethoxypropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate;5-[2-(adamantane-1-carbonyloxy)-1,1,1-trifluoro-3-oxo-3-propan-2-yloxypropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate;5-[2-(adamantane-1-carbonyloxy)-1,1,1-trifluoro-3-oxo-3-propoxypropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate (PubChem CID 159322954) has the molecular formula C142H164F42O48S6-6
and a molecular weight of 3629.14 g/mol. Its IUPAC name is 5-[2-(adamantane-1-carbonyloxy)-3-ethoxy-1,1,1-trifluoro-3-oxopropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate;5-[2-(adamantane-1-carbonyloxy)-1,1,1-trifluoro-3-(4-methylphenoxy)-3-oxopropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate;5-[2-(adamantane-1-carbonyloxy)-1,1,1-trifluoro-3-oxo-3-phenoxypropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate;5-[2-(adamantane-1-carbonyloxy)-1,1,1-trifluoro-3-oxo-3-phenylmethoxypropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate;5-[2-(adamantane-1-carbonyloxy)-1,1,1-trifluoro-3-oxo-3-propan-2-yloxypropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate;5-[2-(adamantane-1-carbonyloxy)-1,1,1-trifluoro-3-oxo-3-propoxypropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate.
Frequently Asked Questions
What is the IUPAC name of 5-[2-(adamantane-1-carbonyloxy)-3-ethoxy-1,1,1-trifluoro-3-oxopropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate;5-[2-(adamantane-1-carbonyloxy)-1,1,1-trifluoro-3-(4-methylphenoxy)-3-oxopropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate;5-[2-(adamantane-1-carbonyloxy)-1,1,1-trifluoro-3-oxo-3-phenoxypropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate;5-[2-(adamantane-1-carbonyloxy)-1,1,1-trifluoro-3-oxo-3-phenylmethoxypropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate;5-[2-(adamantane-1-carbonyloxy)-1,1,1-trifluoro-3-oxo-3-propan-2-yloxypropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate;5-[2-(adamantane-1-carbonyloxy)-1,1,1-trifluoro-3-oxo-3-propoxypropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate?
The IUPAC name of 5-[2-(adamantane-1-carbonyloxy)-3-ethoxy-1,1,1-trifluoro-3-oxopropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate;5-[2-(adamantane-1-carbonyloxy)-1,1,1-trifluoro-3-(4-methylphenoxy)-3-oxopropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate;5-[2-(adamantane-1-carbonyloxy)-1,1,1-trifluoro-3-oxo-3-phenoxypropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate;5-[2-(adamantane-1-carbonyloxy)-1,1,1-trifluoro-3-oxo-3-phenylmethoxypropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate;5-[2-(adamantane-1-carbonyloxy)-1,1,1-trifluoro-3-oxo-3-propan-2-yloxypropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate;5-[2-(adamantane-1-carbonyloxy)-1,1,1-trifluoro-3-oxo-3-propoxypropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate (CID 159322954) is 5-[2-(adamantane-1-carbonyloxy)-3-ethoxy-1,1,1-trifluoro-3-oxopropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate;5-[2-(adamantane-1-carbonyloxy)-1,1,1-trifluoro-3-(4-methylphenoxy)-3-oxopropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate;5-[2-(adamantane-1-carbonyloxy)-1,1,1-trifluoro-3-oxo-3-phenoxypropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate;5-[2-(adamantane-1-carbonyloxy)-1,1,1-trifluoro-3-oxo-3-phenylmethoxypropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate;5-[2-(adamantane-1-carbonyloxy)-1,1,1-trifluoro-3-oxo-3-propan-2-yloxypropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate;5-[2-(adamantane-1-carbonyloxy)-1,1,1-trifluoro-3-oxo-3-propoxypropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate.
What is the SMILES notation for 5-[2-(adamantane-1-carbonyloxy)-3-ethoxy-1,1,1-trifluoro-3-oxopropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate;5-[2-(adamantane-1-carbonyloxy)-1,1,1-trifluoro-3-(4-methylphenoxy)-3-oxopropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate;5-[2-(adamantane-1-carbonyloxy)-1,1,1-trifluoro-3-oxo-3-phenoxypropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate;5-[2-(adamantane-1-carbonyloxy)-1,1,1-trifluoro-3-oxo-3-phenylmethoxypropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate;5-[2-(adamantane-1-carbonyloxy)-1,1,1-trifluoro-3-oxo-3-propan-2-yloxypropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate;5-[2-(adamantane-1-carbonyloxy)-1,1,1-trifluoro-3-oxo-3-propoxypropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate?
The canonical SMILES for 5-[2-(adamantane-1-carbonyloxy)-3-ethoxy-1,1,1-trifluoro-3-oxopropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate;5-[2-(adamantane-1-carbonyloxy)-1,1,1-trifluoro-3-(4-methylphenoxy)-3-oxopropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate;5-[2-(adamantane-1-carbonyloxy)-1,1,1-trifluoro-3-oxo-3-phenoxypropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate;5-[2-(adamantane-1-carbonyloxy)-1,1,1-trifluoro-3-oxo-3-phenylmethoxypropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate;5-[2-(adamantane-1-carbonyloxy)-1,1,1-trifluoro-3-oxo-3-propan-2-yloxypropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate;5-[2-(adamantane-1-carbonyloxy)-1,1,1-trifluoro-3-oxo-3-propoxypropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate is CC(C)OC(=O)C(OCCCC(F)(F)C(F)(F)S(=O)(=O)[O-])(OC(=O)C12CC3CC(CC(C3)C1)C2)C(F)(F)F.CCCOC(=O)C(OCCCC(F)(F)C(F)(F)S(=O)(=O)[O-])(OC(=O)C12CC3CC(CC(C3)C1)C2)C(F)(F)F.CCOC(=O)C(OCCCC(F)(F)C(F)(F)S(=O)(=O)[O-])(OC(=O)C12CC3CC(CC(C3)C1)C2)C(F)(F)F.Cc1ccc(OC(=O)C(OCCCC(F)(F)C(F)(F)S(=O)(=O)[O-])(OC(=O)C23CC4CC(CC(C4)C2)C3)C(F)(F)F)cc1.O=C(OC(OCCCC(F)(F)C(F)(F)S(=O)(=O)[O-])(C(=O)OCc1ccccc1)C(F)(F)F)C12CC3CC(CC(C3)C1)C2.O=C(OC(OCCCC(F)(F)C(F)(F)S(=O)(=O)[O-])(C(=O)Oc1ccccc1)C(F)(F)F)C12CC3CC(CC(C3)C1)C2.
What is the InChIKey of 5-[2-(adamantane-1-carbonyloxy)-3-ethoxy-1,1,1-trifluoro-3-oxopropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate;5-[2-(adamantane-1-carbonyloxy)-1,1,1-trifluoro-3-(4-methylphenoxy)-3-oxopropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate;5-[2-(adamantane-1-carbonyloxy)-1,1,1-trifluoro-3-oxo-3-phenoxypropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate;5-[2-(adamantane-1-carbonyloxy)-1,1,1-trifluoro-3-oxo-3-phenylmethoxypropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate;5-[2-(adamantane-1-carbonyloxy)-1,1,1-trifluoro-3-oxo-3-propan-2-yloxypropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate;5-[2-(adamantane-1-carbonyloxy)-1,1,1-trifluoro-3-oxo-3-propoxypropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate?
The InChIKey is LDZNTLJYCFOBGD-UHFFFAOYSA-H. The full InChI is InChI=1S/2C26H29F7O8S.C25H27F7O8S.2C22H29F7O8S.C21H27F7O8S/c1-15-3-5-19(6-4-15)40-21(35)24(25(29,30)31,39-8-2-7-23(27,28)26(32,33)42(36,37)38)41-20(34)22-12-16-9-17(13-22)11-18(10-16)14-22;27-23(28,26(32,33)42(36,37)38)7-4-8-40-24(25(29,30)31,21(35)39-15-16-5-2-1-3-6-16)41-20(34)22-12-17-9-18(13-22)11-19(10-17)14-22;26-22(27,25(31,32)41(35,36)37)7-4-8-38-23(24(28,29)30,20(34)39-18-5-2-1-3-6-18)40-19(33)21-12-15-9-16(13-21)11-17(10-15)14-21;1-12(2)36-17(31)20(21(25,26)27,35-5-3-4-19(23,24)22(28,29)38(32,33)34)37-16(30)18-9-13-6-14(10-18)8-15(7-13)11-18;1-2-5-35-17(31)20(21(25,26)27,36-6-3-4-19(23,24)22(28,29)38(32,33)34)37-16(30)18-10-13-7-14(11-18)9-15(8-13)12-18;1-2-34-16(30)19(20(24,25)26,35-5-3-4-18(22,23)21(27,28)37(31,32)33)36-15(29)17-9-12-6-13(10-17)8-14(7-12)11-17/h3-6,16-18H,2,7-14H2,1H3,(H,36,37,38);1-3,5-6,17-19H,4,7-15H2,(H,36,37,38);1-3,5-6,15-17H,4,7-14H2,(H,35,36,37);12-15H,3-11H2,1-2H3,(H,32,33,34);13-15H,2-12H2,1H3,(H,32,33,34);12-14H,2-11H2,1H3,(H,31,32,33)/p-6.
What are the key properties of 5-[2-(adamantane-1-carbonyloxy)-3-ethoxy-1,1,1-trifluoro-3-oxopropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate;5-[2-(adamantane-1-carbonyloxy)-1,1,1-trifluoro-3-(4-methylphenoxy)-3-oxopropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate;5-[2-(adamantane-1-carbonyloxy)-1,1,1-trifluoro-3-oxo-3-phenoxypropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate;5-[2-(adamantane-1-carbonyloxy)-1,1,1-trifluoro-3-oxo-3-phenylmethoxypropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate;5-[2-(adamantane-1-carbonyloxy)-1,1,1-trifluoro-3-oxo-3-propan-2-yloxypropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate;5-[2-(adamantane-1-carbonyloxy)-1,1,1-trifluoro-3-oxo-3-propoxypropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate?
5-[2-(adamantane-1-carbonyloxy)-3-ethoxy-1,1,1-trifluoro-3-oxopropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate;5-[2-(adamantane-1-carbonyloxy)-1,1,1-trifluoro-3-(4-methylphenoxy)-3-oxopropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate;5-[2-(adamantane-1-carbonyloxy)-1,1,1-trifluoro-3-oxo-3-phenoxypropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate;5-[2-(adamantane-1-carbonyloxy)-1,1,1-trifluoro-3-oxo-3-phenylmethoxypropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate;5-[2-(adamantane-1-carbonyloxy)-1,1,1-trifluoro-3-oxo-3-propan-2-yloxypropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate;5-[2-(adamantane-1-carbonyloxy)-1,1,1-trifluoro-3-oxo-3-propoxypropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate has a molecular weight of 3629.14 g/mol, XLogP of 29.18, 68 rotatable bonds, 0 hydrogen bond donors, and 48 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(adamantane-1-carbonyloxy)-3-ethoxy-1,1,1-trifluoro-3-oxopropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate;5-[2-(adamantane-1-carbonyloxy)-1,1,1-trifluoro-3-(4-methylphenoxy)-3-oxopropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate;5-[2-(adamantane-1-carbonyloxy)-1,1,1-trifluoro-3-oxo-3-phenoxypropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate;5-[2-(adamantane-1-carbonyloxy)-1,1,1-trifluoro-3-oxo-3-phenylmethoxypropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate;5-[2-(adamantane-1-carbonyloxy)-1,1,1-trifluoro-3-oxo-3-propan-2-yloxypropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate;5-[2-(adamantane-1-carbonyloxy)-1,1,1-trifluoro-3-oxo-3-propoxypropan-2-yl]oxy-1,1,2,2-tetrafluoropentane-1-sulfonate is sourced from PubChem (CID 159322954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).