About [4-[2,5-diethyl-4-(3-methylsulfonyloxy-4-phenylmethoxyphenyl)phenyl]phenyl] methanesulfonate;4-[4-[3-fluoro-4-(3-methylbut-2-enoxy)phenyl]-2,5-dimethylphenyl]phenol;[4-[4-[3-fluoro-4-(3-methylbut-2-enoxy)phenyl]-2,5-dimethylphenyl]phenyl] methanesulfonate;[4-[4-(4-fluorophenyl)-3,6-dimethoxy-2-methylsulfonyloxyphenyl]-2-(3-methylbut-2-enoxy)phenyl] trifluoromethanesulfonate;[5-[4-(4-fluorophenyl)-3,6-dimethoxy-2-methylsulfonyloxyphenyl]-2-(3-methylbut-2-enoxy)phenyl] trifluoromethanesulfonate;[5-[4-(4-fluorophenyl)-3,6-dimethoxy-2-methylsulfonyloxyphenyl]-2-phenylmethoxyphenyl] trifluoromethanesulfonate;[5-[4-(4-hydroxyphenyl)-3,6-dimethyl-2-methylsulfonyloxyphenyl]-2-phenylmethoxyphenyl] methanesulfonate
[4-[2,5-diethyl-4-(3-methylsulfonyloxy-4-phenylmethoxyphenyl)phenyl]phenyl] methanesulfonate;4-[4-[3-fluoro-4-(3-methylbut-2-enoxy)phenyl]-2,5-dimethylphenyl]phenol;[4-[4-[3-fluoro-4-(3-methylbut-2-enoxy)phenyl]-2,5-dimethylphenyl]phenyl] methanesulfonate;[4-[4-(4-fluorophenyl)-3,6-dimethoxy-2-methylsulfonyloxyphenyl]-2-(3-methylbut-2-enoxy)phenyl] trifluoromethanesulfonate;[5-[4-(4-fluorophenyl)-3,6-dimethoxy-2-methylsulfonyloxyphenyl]-2-(3-methylbut-2-enoxy)phenyl] trifluoromethanesulfonate;[5-[4-(4-fluorophenyl)-3,6-dimethoxy-2-methylsulfonyloxyphenyl]-2-phenylmethoxyphenyl] trifluoromethanesulfonate;[5-[4-(4-hydroxyphenyl)-3,6-dimethyl-2-methylsulfonyloxyphenyl]-2-phenylmethoxyphenyl] methanesulfonate (PubChem CID 157424249) has the molecular formula C194H188F14O48S11
and a molecular weight of 3906.30 g/mol. Its IUPAC name is [4-[2,5-diethyl-4-(3-methylsulfonyloxy-4-phenylmethoxyphenyl)phenyl]phenyl] methanesulfonate;4-[4-[3-fluoro-4-(3-methylbut-2-enoxy)phenyl]-2,5-dimethylphenyl]phenol;[4-[4-[3-fluoro-4-(3-methylbut-2-enoxy)phenyl]-2,5-dimethylphenyl]phenyl] methanesulfonate;[4-[4-(4-fluorophenyl)-3,6-dimethoxy-2-methylsulfonyloxyphenyl]-2-(3-methylbut-2-enoxy)phenyl] trifluoromethanesulfonate;[5-[4-(4-fluorophenyl)-3,6-dimethoxy-2-methylsulfonyloxyphenyl]-2-(3-methylbut-2-enoxy)phenyl] trifluoromethanesulfonate;[5-[4-(4-fluorophenyl)-3,6-dimethoxy-2-methylsulfonyloxyphenyl]-2-phenylmethoxyphenyl] trifluoromethanesulfonate;[5-[4-(4-hydroxyphenyl)-3,6-dimethyl-2-methylsulfonyloxyphenyl]-2-phenylmethoxyphenyl] methanesulfonate.
Frequently Asked Questions
What is the IUPAC name of [4-[2,5-diethyl-4-(3-methylsulfonyloxy-4-phenylmethoxyphenyl)phenyl]phenyl] methanesulfonate;4-[4-[3-fluoro-4-(3-methylbut-2-enoxy)phenyl]-2,5-dimethylphenyl]phenol;[4-[4-[3-fluoro-4-(3-methylbut-2-enoxy)phenyl]-2,5-dimethylphenyl]phenyl] methanesulfonate;[4-[4-(4-fluorophenyl)-3,6-dimethoxy-2-methylsulfonyloxyphenyl]-2-(3-methylbut-2-enoxy)phenyl] trifluoromethanesulfonate;[5-[4-(4-fluorophenyl)-3,6-dimethoxy-2-methylsulfonyloxyphenyl]-2-(3-methylbut-2-enoxy)phenyl] trifluoromethanesulfonate;[5-[4-(4-fluorophenyl)-3,6-dimethoxy-2-methylsulfonyloxyphenyl]-2-phenylmethoxyphenyl] trifluoromethanesulfonate;[5-[4-(4-hydroxyphenyl)-3,6-dimethyl-2-methylsulfonyloxyphenyl]-2-phenylmethoxyphenyl] methanesulfonate?
The IUPAC name of [4-[2,5-diethyl-4-(3-methylsulfonyloxy-4-phenylmethoxyphenyl)phenyl]phenyl] methanesulfonate;4-[4-[3-fluoro-4-(3-methylbut-2-enoxy)phenyl]-2,5-dimethylphenyl]phenol;[4-[4-[3-fluoro-4-(3-methylbut-2-enoxy)phenyl]-2,5-dimethylphenyl]phenyl] methanesulfonate;[4-[4-(4-fluorophenyl)-3,6-dimethoxy-2-methylsulfonyloxyphenyl]-2-(3-methylbut-2-enoxy)phenyl] trifluoromethanesulfonate;[5-[4-(4-fluorophenyl)-3,6-dimethoxy-2-methylsulfonyloxyphenyl]-2-(3-methylbut-2-enoxy)phenyl] trifluoromethanesulfonate;[5-[4-(4-fluorophenyl)-3,6-dimethoxy-2-methylsulfonyloxyphenyl]-2-phenylmethoxyphenyl] trifluoromethanesulfonate;[5-[4-(4-hydroxyphenyl)-3,6-dimethyl-2-methylsulfonyloxyphenyl]-2-phenylmethoxyphenyl] methanesulfonate (CID 157424249) is [4-[2,5-diethyl-4-(3-methylsulfonyloxy-4-phenylmethoxyphenyl)phenyl]phenyl] methanesulfonate;4-[4-[3-fluoro-4-(3-methylbut-2-enoxy)phenyl]-2,5-dimethylphenyl]phenol;[4-[4-[3-fluoro-4-(3-methylbut-2-enoxy)phenyl]-2,5-dimethylphenyl]phenyl] methanesulfonate;[4-[4-(4-fluorophenyl)-3,6-dimethoxy-2-methylsulfonyloxyphenyl]-2-(3-methylbut-2-enoxy)phenyl] trifluoromethanesulfonate;[5-[4-(4-fluorophenyl)-3,6-dimethoxy-2-methylsulfonyloxyphenyl]-2-(3-methylbut-2-enoxy)phenyl] trifluoromethanesulfonate;[5-[4-(4-fluorophenyl)-3,6-dimethoxy-2-methylsulfonyloxyphenyl]-2-phenylmethoxyphenyl] trifluoromethanesulfonate;[5-[4-(4-hydroxyphenyl)-3,6-dimethyl-2-methylsulfonyloxyphenyl]-2-phenylmethoxyphenyl] methanesulfonate.
What is the SMILES notation for [4-[2,5-diethyl-4-(3-methylsulfonyloxy-4-phenylmethoxyphenyl)phenyl]phenyl] methanesulfonate;4-[4-[3-fluoro-4-(3-methylbut-2-enoxy)phenyl]-2,5-dimethylphenyl]phenol;[4-[4-[3-fluoro-4-(3-methylbut-2-enoxy)phenyl]-2,5-dimethylphenyl]phenyl] methanesulfonate;[4-[4-(4-fluorophenyl)-3,6-dimethoxy-2-methylsulfonyloxyphenyl]-2-(3-methylbut-2-enoxy)phenyl] trifluoromethanesulfonate;[5-[4-(4-fluorophenyl)-3,6-dimethoxy-2-methylsulfonyloxyphenyl]-2-(3-methylbut-2-enoxy)phenyl] trifluoromethanesulfonate;[5-[4-(4-fluorophenyl)-3,6-dimethoxy-2-methylsulfonyloxyphenyl]-2-phenylmethoxyphenyl] trifluoromethanesulfonate;[5-[4-(4-hydroxyphenyl)-3,6-dimethyl-2-methylsulfonyloxyphenyl]-2-phenylmethoxyphenyl] methanesulfonate?
The canonical SMILES for [4-[2,5-diethyl-4-(3-methylsulfonyloxy-4-phenylmethoxyphenyl)phenyl]phenyl] methanesulfonate;4-[4-[3-fluoro-4-(3-methylbut-2-enoxy)phenyl]-2,5-dimethylphenyl]phenol;[4-[4-[3-fluoro-4-(3-methylbut-2-enoxy)phenyl]-2,5-dimethylphenyl]phenyl] methanesulfonate;[4-[4-(4-fluorophenyl)-3,6-dimethoxy-2-methylsulfonyloxyphenyl]-2-(3-methylbut-2-enoxy)phenyl] trifluoromethanesulfonate;[5-[4-(4-fluorophenyl)-3,6-dimethoxy-2-methylsulfonyloxyphenyl]-2-(3-methylbut-2-enoxy)phenyl] trifluoromethanesulfonate;[5-[4-(4-fluorophenyl)-3,6-dimethoxy-2-methylsulfonyloxyphenyl]-2-phenylmethoxyphenyl] trifluoromethanesulfonate;[5-[4-(4-hydroxyphenyl)-3,6-dimethyl-2-methylsulfonyloxyphenyl]-2-phenylmethoxyphenyl] methanesulfonate is CC(C)=CCOc1ccc(-c2cc(C)c(-c3ccc(O)cc3)cc2C)cc1F.CC(C)=CCOc1ccc(-c2cc(C)c(-c3ccc(OS(C)(=O)=O)cc3)cc2C)cc1F.CCc1cc(-c2ccc(OCc3ccccc3)c(OS(C)(=O)=O)c2)c(CC)cc1-c1ccc(OS(C)(=O)=O)cc1.COc1cc(-c2ccc(F)cc2)c(OC)c(OS(C)(=O)=O)c1-c1ccc(OCC=C(C)C)c(OS(=O)(=O)C(F)(F)F)c1.COc1cc(-c2ccc(F)cc2)c(OC)c(OS(C)(=O)=O)c1-c1ccc(OCc2ccccc2)c(OS(=O)(=O)C(F)(F)F)c1.COc1cc(-c2ccc(F)cc2)c(OC)c(OS(C)(=O)=O)c1-c1ccc(OS(=O)(=O)C(F)(F)F)c(OCC=C(C)C)c1.Cc1cc(-c2ccc(O)cc2)c(C)c(OS(C)(=O)=O)c1-c1ccc(OCc2ccccc2)c(OS(C)(=O)=O)c1.
What is the InChIKey of [4-[2,5-diethyl-4-(3-methylsulfonyloxy-4-phenylmethoxyphenyl)phenyl]phenyl] methanesulfonate;4-[4-[3-fluoro-4-(3-methylbut-2-enoxy)phenyl]-2,5-dimethylphenyl]phenol;[4-[4-[3-fluoro-4-(3-methylbut-2-enoxy)phenyl]-2,5-dimethylphenyl]phenyl] methanesulfonate;[4-[4-(4-fluorophenyl)-3,6-dimethoxy-2-methylsulfonyloxyphenyl]-2-(3-methylbut-2-enoxy)phenyl] trifluoromethanesulfonate;[5-[4-(4-fluorophenyl)-3,6-dimethoxy-2-methylsulfonyloxyphenyl]-2-(3-methylbut-2-enoxy)phenyl] trifluoromethanesulfonate;[5-[4-(4-fluorophenyl)-3,6-dimethoxy-2-methylsulfonyloxyphenyl]-2-phenylmethoxyphenyl] trifluoromethanesulfonate;[5-[4-(4-hydroxyphenyl)-3,6-dimethyl-2-methylsulfonyloxyphenyl]-2-phenylmethoxyphenyl] methanesulfonate?
The InChIKey is BPTSZAHXFXWDPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H32O7S2.C29H24F4O9S2.C29H28O8S2.2C27H26F4O9S2.C26H27FO4S.C25H25FO2/c1-5-23-19-29(24(6-2)18-28(23)25-12-15-27(16-13-25)37-39(3,32)33)26-14-17-30(31(20-26)38-40(4,34)35)36-21-22-10-8-7-9-11-22;1-38-25-16-22(19-9-12-21(30)13-10-19)27(39-2)28(42-43(3,34)35)26(25)20-11-14-23(40-17-18-7-5-4-6-8-18)24(15-20)41-44(36,37)29(31,32)33;1-19-16-25(22-10-13-24(30)14-11-22)20(2)29(37-39(4,33)34)28(19)23-12-15-26(27(17-23)36-38(3,31)32)35-18-21-8-6-5-7-9-21;1-16(2)12-13-38-22-14-18(8-11-21(22)39-42(34,35)27(29,30)31)24-23(36-3)15-20(17-6-9-19(28)10-7-17)25(37-4)26(24)40-41(5,32)33;1-16(2)12-13-38-21-11-8-18(14-22(21)39-42(34,35)27(29,30)31)24-23(36-3)15-20(17-6-9-19(28)10-7-17)25(37-4)26(24)40-41(5,32)33;1-17(2)12-13-30-26-11-8-21(16-25(26)27)24-15-18(3)23(14-19(24)4)20-6-9-22(10-7-20)31-32(5,28)29;1-16(2)11-12-28-25-10-7-20(15-24(25)26)23-14-17(3)22(13-18(23)4)19-5-8-21(27)9-6-19/h7-20H,5-6,21H2,1-4H3;4-16H,17H2,1-3H3;5-17,30H,18H2,1-4H3;2*6-12,14-15H,13H2,1-5H3;6-12,14-16H,13H2,1-5H3;5-11,13-15,27H,12H2,1-4H3.
What are the key properties of [4-[2,5-diethyl-4-(3-methylsulfonyloxy-4-phenylmethoxyphenyl)phenyl]phenyl] methanesulfonate;4-[4-[3-fluoro-4-(3-methylbut-2-enoxy)phenyl]-2,5-dimethylphenyl]phenol;[4-[4-[3-fluoro-4-(3-methylbut-2-enoxy)phenyl]-2,5-dimethylphenyl]phenyl] methanesulfonate;[4-[4-(4-fluorophenyl)-3,6-dimethoxy-2-methylsulfonyloxyphenyl]-2-(3-methylbut-2-enoxy)phenyl] trifluoromethanesulfonate;[5-[4-(4-fluorophenyl)-3,6-dimethoxy-2-methylsulfonyloxyphenyl]-2-(3-methylbut-2-enoxy)phenyl] trifluoromethanesulfonate;[5-[4-(4-fluorophenyl)-3,6-dimethoxy-2-methylsulfonyloxyphenyl]-2-phenylmethoxyphenyl] trifluoromethanesulfonate;[5-[4-(4-hydroxyphenyl)-3,6-dimethyl-2-methylsulfonyloxyphenyl]-2-phenylmethoxyphenyl] methanesulfonate?
[4-[2,5-diethyl-4-(3-methylsulfonyloxy-4-phenylmethoxyphenyl)phenyl]phenyl] methanesulfonate;4-[4-[3-fluoro-4-(3-methylbut-2-enoxy)phenyl]-2,5-dimethylphenyl]phenol;[4-[4-[3-fluoro-4-(3-methylbut-2-enoxy)phenyl]-2,5-dimethylphenyl]phenyl] methanesulfonate;[4-[4-(4-fluorophenyl)-3,6-dimethoxy-2-methylsulfonyloxyphenyl]-2-(3-methylbut-2-enoxy)phenyl] trifluoromethanesulfonate;[5-[4-(4-fluorophenyl)-3,6-dimethoxy-2-methylsulfonyloxyphenyl]-2-(3-methylbut-2-enoxy)phenyl] trifluoromethanesulfonate;[5-[4-(4-fluorophenyl)-3,6-dimethoxy-2-methylsulfonyloxyphenyl]-2-phenylmethoxyphenyl] trifluoromethanesulfonate;[5-[4-(4-hydroxyphenyl)-3,6-dimethyl-2-methylsulfonyloxyphenyl]-2-phenylmethoxyphenyl] methanesulfonate has a molecular weight of 3906.30 g/mol, XLogP of 43.79, 65 rotatable bonds, 2 hydrogen bond donors, and 48 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[2,5-diethyl-4-(3-methylsulfonyloxy-4-phenylmethoxyphenyl)phenyl]phenyl] methanesulfonate;4-[4-[3-fluoro-4-(3-methylbut-2-enoxy)phenyl]-2,5-dimethylphenyl]phenol;[4-[4-[3-fluoro-4-(3-methylbut-2-enoxy)phenyl]-2,5-dimethylphenyl]phenyl] methanesulfonate;[4-[4-(4-fluorophenyl)-3,6-dimethoxy-2-methylsulfonyloxyphenyl]-2-(3-methylbut-2-enoxy)phenyl] trifluoromethanesulfonate;[5-[4-(4-fluorophenyl)-3,6-dimethoxy-2-methylsulfonyloxyphenyl]-2-(3-methylbut-2-enoxy)phenyl] trifluoromethanesulfonate;[5-[4-(4-fluorophenyl)-3,6-dimethoxy-2-methylsulfonyloxyphenyl]-2-phenylmethoxyphenyl] trifluoromethanesulfonate;[5-[4-(4-hydroxyphenyl)-3,6-dimethyl-2-methylsulfonyloxyphenyl]-2-phenylmethoxyphenyl] methanesulfonate is sourced from PubChem (CID 157424249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).