2-[4-bis[4-[(2-methylpropan-2-yl)oxy]phenyl]sulfoniophenoxy]-1,1-difluoroethanesulfonate;2-[4-bis[4-[(2-methylpropan-2-yl)oxy]phenyl]sulfoniophenoxy]-1,1,3,3,3-pentafluoropropane-1-sulfonate;1,1-difluoro-2-[4-[[4-[(2-methylpropan-2-yl)oxy]phenyl]-phenylsulfonio]phenoxy]ethanesulfonate;2-(4-diphenylsulfonio-2,6-dimethylphenoxy)-1,1-difluoroethanesulfonate;2-(4-diphenylsulfonio-2,6-dimethylphenoxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-[4-(4-diphenylsulfoniophenoxy)benzoyl]oxy-1,1-difluoroethanesulfonate;2-[4-(4-diphenylsulfoniophenoxy)benzoyl]oxy-1,1-difluoropropane-1-sulfonate;2-[5-(4-diphenylsulfoniophenoxy)naphthalene-1-carbonyl]oxy-1,1-difluoroethanesulfonate;2-[6-(4-diphenylsulfoniophenoxy)naphthalene-2-carbonyl]oxy-1,1-difluoroethanesulfonate;2-[5-(4-diphenylsulfoniophenoxy)naphthalene-1-carbonyl]oxy-1,1-difluoropropane-1-sulfonate;2-[6-(4-diphenylsulfoniophenoxy)naphthalene-2-carbonyl]oxy-1,1-difluoropropane-1-sulfonate;1,1,3,3,3-pentafluoro-2-[4-[[4-[(2-methylpropan-2-yl)oxy]phenyl]-phenylsulfonio]phenoxy]propane-1-sulfonate

C332H283F33O66S24 — CID 157447152

IUPAC2-[4-bis[4-[(2-methylpropan-2-yl)oxy]phenyl]sulfoniophenoxy]-1,1-difluoroethanesulfonate;2-[4-bis[4-[(2-methylpropan-2-yl)oxy]phenyl]sulfoniophenoxy]-1,1,3,3,3-pentafluoropropane-1-sulfonate;1,1-difluoro-2-[4-[[4-[(2-methylpropan-2-yl)oxy]phenyl]-phenylsulfonio]phenoxy]ethanesulfonate;2-(4-diphenylsulfonio-2,6-dimethylphenoxy)-1,1-difluoroethanesulfonate;2-(4-diphenylsulfonio-2,6-dimethylphenoxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-[4-(4-diphenylsulfoniophenoxy)benzoyl]oxy-1,1-difluoroethanesulfonate;2-[4-(4-diphenylsulfoniophenoxy)benzoyl]oxy-1,1-difluoropropane-1-sulfonate;2-[5-(4-diphenylsulfoniophenoxy)naphthalene-1-carbonyl]oxy-1,1-difluoroethanesulfonate;2-[6-(4-diphenylsulfoniophenoxy)naphthalene-2-carbonyl]oxy-1,1-difluoroethanesulfonate;2-[5-(4-diphenylsulfoniophenoxy)naphthalene-1-carbonyl]oxy-1,1-difluoropropane-1-sulfonate;2-[6-(4-diphenylsulfoniophenoxy)naphthalene-2-carbonyl]oxy-1,1-difluoropropane-1-sulfonate;1,1,3,3,3-pentafluoro-2-[4-[[4-[(2-methylpropan-2-yl)oxy]phenyl]-phenylsulfonio]phenoxy]propane-1-sulfonate
SMILESCC(C)(C)Oc1ccc([S+](c2ccc(OC(C(F)(F)F)C(F)(F)S(=O)(=O)[O-])cc2)c2ccc(OC(C)(C)C)cc2)cc1.CC(C)(C)Oc1ccc([S+](c2ccc(OCC(F)(F)S(=O)(=O)[O-])cc2)c2ccc(OC(C)(C)C)cc2)cc1.CC(C)(C)Oc1ccc([S+](c2ccccc2)c2ccc(OC(C(F)(F)F)C(F)(F)S(=O)(=O)[O-])cc2)cc1.CC(C)(C)Oc1ccc([S+](c2ccccc2)c2ccc(OCC(F)(F)S(=O)(=O)[O-])cc2)cc1.CC(OC(=O)c1ccc(Oc2ccc([S+](c3ccccc3)c3ccccc3)cc2)cc1)C(F)(F)S(=O)(=O)[O-].CC(OC(=O)c1ccc2cc(Oc3ccc([S+](c4ccccc4)c4ccccc4)cc3)ccc2c1)C(F)(F)S(=O)(=O)[O-].CC(OC(=O)c1cccc2c(Oc3ccc([S+](c4ccccc4)c4ccccc4)cc3)cccc12)C(F)(F)S(=O)(=O)[O-].Cc1cc([S+](c2ccccc2)c2ccccc2)cc(C)c1OC(C(F)(F)F)C(F)(F)S(=O)(=O)[O-].Cc1cc([S+](c2ccccc2)c2ccccc2)cc(C)c1OCC(F)(F)S(=O)(=O)[O-].O=C(OCC(F)(F)S(=O)(=O)[O-])c1ccc(Oc2ccc([S+](c3ccccc3)c3ccccc3)cc2)cc1.O=C(OCC(F)(F)S(=O)(=O)[O-])c1ccc2cc(Oc3ccc([S+](c4ccccc4)c4ccccc4)cc3)ccc2c1.O=C(OCC(F)(F)S(=O)(=O)[O-])c1cccc2c(Oc3ccc([S+](c4ccccc4)c4ccccc4)cc3)cccc12
InChIInChI=1S/2C32H24F2O6S2.2C31H22F2O6S2.C29H31F5O6S2.C28H22F2O6S2.C28H32F2O6S2.C27H20F2O6S2.C25H23F5O5S2.C24H24F2O5S2.C23H19F5O4S2.C22H20F2O4S2/c1-22(32(33,34)42(36,37)38)39-31(35)29-16-8-15-28-27(29)14-9-17-30(28)40-23-18-20-26(21-19-23)41(24-10-4-2-5-11-24)25-12-6-3-7-13-25;1-22(32(33,34)42(36,37)38)39-31(35)25-13-12-24-21-27(15-14-23(24)20-25)40-26-16-18-30(19-17-26)41(28-8-4-2-5-9-28)29-10-6-3-7-11-29;32-31(33,41(35,36)37)21-38-30(34)28-15-7-14-27-26(28)13-8-16-29(27)39-22-17-19-25(20-18-22)40(23-9-3-1-4-10-23)24-11-5-2-6-12-24;32-31(33,41(35,36)37)21-38-30(34)24-12-11-23-20-26(14-13-22(23)19-24)39-25-15-17-29(18-16-25)40(27-7-3-1-4-8-27)28-9-5-2-6-10-28;1-26(2,3)39-20-9-15-23(16-10-20)41(24-17-11-21(12-18-24)40-27(4,5)6)22-13-7-19(8-14-22)38-25(28(30,31)32)29(33,34)42(35,36)37;1-20(28(29,30)38(32,33)34)35-27(31)21-12-14-22(15-13-21)36-23-16-18-26(19-17-23)37(24-8-4-2-5-9-24)25-10-6-3-7-11-25;1-26(2,3)35-21-9-15-24(16-10-21)37(25-17-11-22(12-18-25)36-27(4,5)6)23-13-7-20(8-14-23)34-19-28(29,30)38(31,32)33;28-27(29,37(31,32)33)19-34-26(30)20-11-13-21(14-12-20)35-22-15-17-25(18-16-22)36(23-7-3-1-4-8-23)24-9-5-2-6-10-24;1-23(2,3)35-18-11-15-21(16-12-18)36(19-7-5-4-6-8-19)20-13-9-17(10-14-20)34-22(24(26,27)28)25(29,30)37(31,32)33;1-23(2,3)31-19-11-15-22(16-12-19)32(20-7-5-4-6-8-20)21-13-9-18(10-14-21)30-17-24(25,26)33(27,28)29;1-15-13-19(33(17-9-5-3-6-10-17)18-11-7-4-8-12-18)14-16(2)20(15)32-21(22(24,25)26)23(27,28)34(29,30)31;1-16-13-20(14-17(2)21(16)28-15-22(23,24)30(25,26)27)29(18-9-5-3-6-10-18)19-11-7-4-8-12-19/h2*2-22H,1H3;2*1-20H,21H2;7-18,25H,1-6H3;2-20H,1H3;7-18H,19H2,1-6H3;1-18H,19H2;4-16,22H,1-3H3;4-16H,17H2,1-3H3;3-14,21H,1-2H3;3-14H,15H2,1-2H3
InChIKeyBSIWPSGCXFPYDO-UHFFFAOYSA-N
MW6725.39 g/mol
LogP77.88
Rot. Bonds102

About 2-[4-bis[4-[(2-methylpropan-2-yl)oxy]phenyl]sulfoniophenoxy]-1,1-difluoroethanesulfonate;2-[4-bis[4-[(2-methylpropan-2-yl)oxy]phenyl]sulfoniophenoxy]-1,1,3,3,3-pentafluoropropane-1-sulfonate;1,1-difluoro-2-[4-[[4-[(2-methylpropan-2-yl)oxy]phenyl]-phenylsulfonio]phenoxy]ethanesulfonate;2-(4-diphenylsulfonio-2,6-dimethylphenoxy)-1,1-difluoroethanesulfonate;2-(4-diphenylsulfonio-2,6-dimethylphenoxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-[4-(4-diphenylsulfoniophenoxy)benzoyl]oxy-1,1-difluoroethanesulfonate;2-[4-(4-diphenylsulfoniophenoxy)benzoyl]oxy-1,1-difluoropropane-1-sulfonate;2-[5-(4-diphenylsulfoniophenoxy)naphthalene-1-carbonyl]oxy-1,1-difluoroethanesulfonate;2-[6-(4-diphenylsulfoniophenoxy)naphthalene-2-carbonyl]oxy-1,1-difluoroethanesulfonate;2-[5-(4-diphenylsulfoniophenoxy)naphthalene-1-carbonyl]oxy-1,1-difluoropropane-1-sulfonate;2-[6-(4-diphenylsulfoniophenoxy)naphthalene-2-carbonyl]oxy-1,1-difluoropropane-1-sulfonate;1,1,3,3,3-pentafluoro-2-[4-[[4-[(2-methylpropan-2-yl)oxy]phenyl]-phenylsulfonio]phenoxy]propane-1-sulfonate

2-[4-bis[4-[(2-methylpropan-2-yl)oxy]phenyl]sulfoniophenoxy]-1,1-difluoroethanesulfonate;2-[4-bis[4-[(2-methylpropan-2-yl)oxy]phenyl]sulfoniophenoxy]-1,1,3,3,3-pentafluoropropane-1-sulfonate;1,1-difluoro-2-[4-[[4-[(2-methylpropan-2-yl)oxy]phenyl]-phenylsulfonio]phenoxy]ethanesulfonate;2-(4-diphenylsulfonio-2,6-dimethylphenoxy)-1,1-difluoroethanesulfonate;2-(4-diphenylsulfonio-2,6-dimethylphenoxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-[4-(4-diphenylsulfoniophenoxy)benzoyl]oxy-1,1-difluoroethanesulfonate;2-[4-(4-diphenylsulfoniophenoxy)benzoyl]oxy-1,1-difluoropropane-1-sulfonate;2-[5-(4-diphenylsulfoniophenoxy)naphthalene-1-carbonyl]oxy-1,1-difluoroethanesulfonate;2-[6-(4-diphenylsulfoniophenoxy)naphthalene-2-carbonyl]oxy-1,1-difluoroethanesulfonate;2-[5-(4-diphenylsulfoniophenoxy)naphthalene-1-carbonyl]oxy-1,1-difluoropropane-1-sulfonate;2-[6-(4-diphenylsulfoniophenoxy)naphthalene-2-carbonyl]oxy-1,1-difluoropropane-1-sulfonate;1,1,3,3,3-pentafluoro-2-[4-[[4-[(2-methylpropan-2-yl)oxy]phenyl]-phenylsulfonio]phenoxy]propane-1-sulfonate (PubChem CID 157447152) has the molecular formula C332H283F33O66S24 and a molecular weight of 6725.39 g/mol. Its IUPAC name is 2-[4-bis[4-[(2-methylpropan-2-yl)oxy]phenyl]sulfoniophenoxy]-1,1-difluoroethanesulfonate;2-[4-bis[4-[(2-methylpropan-2-yl)oxy]phenyl]sulfoniophenoxy]-1,1,3,3,3-pentafluoropropane-1-sulfonate;1,1-difluoro-2-[4-[[4-[(2-methylpropan-2-yl)oxy]phenyl]-phenylsulfonio]phenoxy]ethanesulfonate;2-(4-diphenylsulfonio-2,6-dimethylphenoxy)-1,1-difluoroethanesulfonate;2-(4-diphenylsulfonio-2,6-dimethylphenoxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-[4-(4-diphenylsulfoniophenoxy)benzoyl]oxy-1,1-difluoroethanesulfonate;2-[4-(4-diphenylsulfoniophenoxy)benzoyl]oxy-1,1-difluoropropane-1-sulfonate;2-[5-(4-diphenylsulfoniophenoxy)naphthalene-1-carbonyl]oxy-1,1-difluoroethanesulfonate;2-[6-(4-diphenylsulfoniophenoxy)naphthalene-2-carbonyl]oxy-1,1-difluoroethanesulfonate;2-[5-(4-diphenylsulfoniophenoxy)naphthalene-1-carbonyl]oxy-1,1-difluoropropane-1-sulfonate;2-[6-(4-diphenylsulfoniophenoxy)naphthalene-2-carbonyl]oxy-1,1-difluoropropane-1-sulfonate;1,1,3,3,3-pentafluoro-2-[4-[[4-[(2-methylpropan-2-yl)oxy]phenyl]-phenylsulfonio]phenoxy]propane-1-sulfonate.

Molecular Properties

Compound Name2-[4-bis[4-[(2-methylpropan-2-yl)oxy]phenyl]sulfoniophenoxy]-1,1-difluoroethanesulfonate;2-[4-bis[4-[(2-methylpropan-2-yl)oxy]phenyl]sulfoniophenoxy]-1,1,3,3,3-pentafluoropropane-1-sulfonate;1,1-difluoro-2-[4-[[4-[(2-methylpropan-2-yl)oxy]phenyl]-phenylsulfonio]phenoxy]ethanesulfonate;2-(4-diphenylsulfonio-2,6-dimethylphenoxy)-1,1-difluoroethanesulfonate;2-(4-diphenylsulfonio-2,6-dimethylphenoxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-[4-(4-diphenylsulfoniophenoxy)benzoyl]oxy-1,1-difluoroethanesulfonate;2-[4-(4-diphenylsulfoniophenoxy)benzoyl]oxy-1,1-difluoropropane-1-sulfonate;2-[5-(4-diphenylsulfoniophenoxy)naphthalene-1-carbonyl]oxy-1,1-difluoroethanesulfonate;2-[6-(4-diphenylsulfoniophenoxy)naphthalene-2-carbonyl]oxy-1,1-difluoroethanesulfonate;2-[5-(4-diphenylsulfoniophenoxy)naphthalene-1-carbonyl]oxy-1,1-difluoropropane-1-sulfonate;2-[6-(4-diphenylsulfoniophenoxy)naphthalene-2-carbonyl]oxy-1,1-difluoropropane-1-sulfonate;1,1,3,3,3-pentafluoro-2-[4-[[4-[(2-methylpropan-2-yl)oxy]phenyl]-phenylsulfonio]phenoxy]propane-1-sulfonate
PubChem CID157447152
Molecular FormulaC332H283F33O66S24
Molecular Weight6725.39 g/mol
Exact Mass6719.16
IUPAC Name2-[4-bis[4-[(2-methylpropan-2-yl)oxy]phenyl]sulfoniophenoxy]-1,1-difluoroethanesulfonate;2-[4-bis[4-[(2-methylpropan-2-yl)oxy]phenyl]sulfoniophenoxy]-1,1,3,3,3-pentafluoropropane-1-sulfonate;1,1-difluoro-2-[4-[[4-[(2-methylpropan-2-yl)oxy]phenyl]-phenylsulfonio]phenoxy]ethanesulfonate;2-(4-diphenylsulfonio-2,6-dimethylphenoxy)-1,1-difluoroethanesulfonate;2-(4-diphenylsulfonio-2,6-dimethylphenoxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-[4-(4-diphenylsulfoniophenoxy)benzoyl]oxy-1,1-difluoroethanesulfonate;2-[4-(4-diphenylsulfoniophenoxy)benzoyl]oxy-1,1-difluoropropane-1-sulfonate;2-[5-(4-diphenylsulfoniophenoxy)naphthalene-1-carbonyl]oxy-1,1-difluoroethanesulfonate;2-[6-(4-diphenylsulfoniophenoxy)naphthalene-2-carbonyl]oxy-1,1-difluoroethanesulfonate;2-[5-(4-diphenylsulfoniophenoxy)naphthalene-1-carbonyl]oxy-1,1-difluoropropane-1-sulfonate;2-[6-(4-diphenylsulfoniophenoxy)naphthalene-2-carbonyl]oxy-1,1-difluoropropane-1-sulfonate;1,1,3,3,3-pentafluoro-2-[4-[[4-[(2-methylpropan-2-yl)oxy]phenyl]-phenylsulfonio]phenoxy]propane-1-sulfonate
SMILESCC(C)(C)Oc1ccc([S+](c2ccc(OC(C(F)(F)F)C(F)(F)S(=O)(=O)[O-])cc2)c2ccc(OC(C)(C)C)cc2)cc1.CC(C)(C)Oc1ccc([S+](c2ccc(OCC(F)(F)S(=O)(=O)[O-])cc2)c2ccc(OC(C)(C)C)cc2)cc1.CC(C)(C)Oc1ccc([S+](c2ccccc2)c2ccc(OC(C(F)(F)F)C(F)(F)S(=O)(=O)[O-])cc2)cc1.CC(C)(C)Oc1ccc([S+](c2ccccc2)c2ccc(OCC(F)(F)S(=O)(=O)[O-])cc2)cc1.CC(OC(=O)c1ccc(Oc2ccc([S+](c3ccccc3)c3ccccc3)cc2)cc1)C(F)(F)S(=O)(=O)[O-].CC(OC(=O)c1ccc2cc(Oc3ccc([S+](c4ccccc4)c4ccccc4)cc3)ccc2c1)C(F)(F)S(=O)(=O)[O-].CC(OC(=O)c1cccc2c(Oc3ccc([S+](c4ccccc4)c4ccccc4)cc3)cccc12)C(F)(F)S(=O)(=O)[O-].Cc1cc([S+](c2ccccc2)c2ccccc2)cc(C)c1OC(C(F)(F)F)C(F)(F)S(=O)(=O)[O-].Cc1cc([S+](c2ccccc2)c2ccccc2)cc(C)c1OCC(F)(F)S(=O)(=O)[O-].O=C(OCC(F)(F)S(=O)(=O)[O-])c1ccc(Oc2ccc([S+](c3ccccc3)c3ccccc3)cc2)cc1.O=C(OCC(F)(F)S(=O)(=O)[O-])c1ccc2cc(Oc3ccc([S+](c4ccccc4)c4ccccc4)cc3)ccc2c1.O=C(OCC(F)(F)S(=O)(=O)[O-])c1cccc2c(Oc3ccc([S+](c4ccccc4)c4ccccc4)cc3)cccc12
InChIInChI=1S/2C32H24F2O6S2.2C31H22F2O6S2.C29H31F5O6S2.C28H22F2O6S2.C28H32F2O6S2.C27H20F2O6S2.C25H23F5O5S2.C24H24F2O5S2.C23H19F5O4S2.C22H20F2O4S2/c1-22(32(33,34)42(36,37)38)39-31(35)29-16-8-15-28-27(29)14-9-17-30(28)40-23-18-20-26(21-19-23)41(24-10-4-2-5-11-24)25-12-6-3-7-13-25;1-22(32(33,34)42(36,37)38)39-31(35)25-13-12-24-21-27(15-14-23(24)20-25)40-26-16-18-30(19-17-26)41(28-8-4-2-5-9-28)29-10-6-3-7-11-29;32-31(33,41(35,36)37)21-38-30(34)28-15-7-14-27-26(28)13-8-16-29(27)39-22-17-19-25(20-18-22)40(23-9-3-1-4-10-23)24-11-5-2-6-12-24;32-31(33,41(35,36)37)21-38-30(34)24-12-11-23-20-26(14-13-22(23)19-24)39-25-15-17-29(18-16-25)40(27-7-3-1-4-8-27)28-9-5-2-6-10-28;1-26(2,3)39-20-9-15-23(16-10-20)41(24-17-11-21(12-18-24)40-27(4,5)6)22-13-7-19(8-14-22)38-25(28(30,31)32)29(33,34)42(35,36)37;1-20(28(29,30)38(32,33)34)35-27(31)21-12-14-22(15-13-21)36-23-16-18-26(19-17-23)37(24-8-4-2-5-9-24)25-10-6-3-7-11-25;1-26(2,3)35-21-9-15-24(16-10-21)37(25-17-11-22(12-18-25)36-27(4,5)6)23-13-7-20(8-14-23)34-19-28(29,30)38(31,32)33;28-27(29,37(31,32)33)19-34-26(30)20-11-13-21(14-12-20)35-22-15-17-25(18-16-22)36(23-7-3-1-4-8-23)24-9-5-2-6-10-24;1-23(2,3)35-18-11-15-21(16-12-18)36(19-7-5-4-6-8-19)20-13-9-17(10-14-20)34-22(24(26,27)28)25(29,30)37(31,32)33;1-23(2,3)31-19-11-15-22(16-12-19)32(20-7-5-4-6-8-20)21-13-9-18(10-14-21)30-17-24(25,26)33(27,28)29;1-15-13-19(33(17-9-5-3-6-10-17)18-11-7-4-8-12-18)14-16(2)20(15)32-21(22(24,25)26)23(27,28)34(29,30)31;1-16-13-20(14-17(2)21(16)28-15-22(23,24)30(25,26)27)29(18-9-5-3-6-10-18)19-11-7-4-8-12-19/h2*2-22H,1H3;2*1-20H,21H2;7-18,25H,1-6H3;2-20H,1H3;7-18H,19H2,1-6H3;1-18H,19H2;4-16,22H,1-3H3;4-16H,17H2,1-3H3;3-14,21H,1-2H3;3-14H,15H2,1-2H3
InChIKeyBSIWPSGCXFPYDO-UHFFFAOYSA-N
XLogP77.88
TPSA1010.34 Ų
H-Bond Donors
H-Bond Acceptors66
Rotatable Bonds102
Heavy Atoms455
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5006725.39
LogP ≤ 577.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1066

Analyze 2-[4-bis[4-[(2-methylpropan-2-yl)oxy]phenyl]sulfoniophenoxy]-1,1-difluoroethanesulfonate;2-[4-bis[4-[(2-methylpropan-2-yl)oxy]phenyl]sulfoniophenoxy]-1,1,3,3,3-pentafluoropropane-1-sulfonate;1,1-difluoro-2-[4-[[4-[(2-methylpropan-2-yl)oxy]phenyl]-phenylsulfonio]phenoxy]ethanesulfonate;2-(4-diphenylsulfonio-2,6-dimethylphenoxy)-1,1-difluoroethanesulfonate;2-(4-diphenylsulfonio-2,6-dimethylphenoxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-[4-(4-diphenylsulfoniophenoxy)benzoyl]oxy-1,1-difluoroethanesulfonate;2-[4-(4-diphenylsulfoniophenoxy)benzoyl]oxy-1,1-difluoropropane-1-sulfonate;2-[5-(4-diphenylsulfoniophenoxy)naphthalene-1-carbonyl]oxy-1,1-difluoroethanesulfonate;2-[6-(4-diphenylsulfoniophenoxy)naphthalene-2-carbonyl]oxy-1,1-difluoroethanesulfonate;2-[5-(4-diphenylsulfoniophenoxy)naphthalene-1-carbonyl]oxy-1,1-difluoropropane-1-sulfonate;2-[6-(4-diphenylsulfoniophenoxy)naphthalene-2-carbonyl]oxy-1,1-difluoropropane-1-sulfonate;1,1,3,3,3-pentafluoro-2-[4-[[4-[(2-methylpropan-2-yl)oxy]phenyl]-phenylsulfonio]phenoxy]propane-1-sulfonate with MolForge

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What is the IUPAC name of 2-[4-bis[4-[(2-methylpropan-2-yl)oxy]phenyl]sulfoniophenoxy]-1,1-difluoroethanesulfonate;2-[4-bis[4-[(2-methylpropan-2-yl)oxy]phenyl]sulfoniophenoxy]-1,1,3,3,3-pentafluoropropane-1-sulfonate;1,1-difluoro-2-[4-[[4-[(2-methylpropan-2-yl)oxy]phenyl]-phenylsulfonio]phenoxy]ethanesulfonate;2-(4-diphenylsulfonio-2,6-dimethylphenoxy)-1,1-difluoroethanesulfonate;2-(4-diphenylsulfonio-2,6-dimethylphenoxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-[4-(4-diphenylsulfoniophenoxy)benzoyl]oxy-1,1-difluoroethanesulfonate;2-[4-(4-diphenylsulfoniophenoxy)benzoyl]oxy-1,1-difluoropropane-1-sulfonate;2-[5-(4-diphenylsulfoniophenoxy)naphthalene-1-carbonyl]oxy-1,1-difluoroethanesulfonate;2-[6-(4-diphenylsulfoniophenoxy)naphthalene-2-carbonyl]oxy-1,1-difluoroethanesulfonate;2-[5-(4-diphenylsulfoniophenoxy)naphthalene-1-carbonyl]oxy-1,1-difluoropropane-1-sulfonate;2-[6-(4-diphenylsulfoniophenoxy)naphthalene-2-carbonyl]oxy-1,1-difluoropropane-1-sulfonate;1,1,3,3,3-pentafluoro-2-[4-[[4-[(2-methylpropan-2-yl)oxy]phenyl]-phenylsulfonio]phenoxy]propane-1-sulfonate?
The IUPAC name of 2-[4-bis[4-[(2-methylpropan-2-yl)oxy]phenyl]sulfoniophenoxy]-1,1-difluoroethanesulfonate;2-[4-bis[4-[(2-methylpropan-2-yl)oxy]phenyl]sulfoniophenoxy]-1,1,3,3,3-pentafluoropropane-1-sulfonate;1,1-difluoro-2-[4-[[4-[(2-methylpropan-2-yl)oxy]phenyl]-phenylsulfonio]phenoxy]ethanesulfonate;2-(4-diphenylsulfonio-2,6-dimethylphenoxy)-1,1-difluoroethanesulfonate;2-(4-diphenylsulfonio-2,6-dimethylphenoxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-[4-(4-diphenylsulfoniophenoxy)benzoyl]oxy-1,1-difluoroethanesulfonate;2-[4-(4-diphenylsulfoniophenoxy)benzoyl]oxy-1,1-difluoropropane-1-sulfonate;2-[5-(4-diphenylsulfoniophenoxy)naphthalene-1-carbonyl]oxy-1,1-difluoroethanesulfonate;2-[6-(4-diphenylsulfoniophenoxy)naphthalene-2-carbonyl]oxy-1,1-difluoroethanesulfonate;2-[5-(4-diphenylsulfoniophenoxy)naphthalene-1-carbonyl]oxy-1,1-difluoropropane-1-sulfonate;2-[6-(4-diphenylsulfoniophenoxy)naphthalene-2-carbonyl]oxy-1,1-difluoropropane-1-sulfonate;1,1,3,3,3-pentafluoro-2-[4-[[4-[(2-methylpropan-2-yl)oxy]phenyl]-phenylsulfonio]phenoxy]propane-1-sulfonate (CID 157447152) is 2-[4-bis[4-[(2-methylpropan-2-yl)oxy]phenyl]sulfoniophenoxy]-1,1-difluoroethanesulfonate;2-[4-bis[4-[(2-methylpropan-2-yl)oxy]phenyl]sulfoniophenoxy]-1,1,3,3,3-pentafluoropropane-1-sulfonate;1,1-difluoro-2-[4-[[4-[(2-methylpropan-2-yl)oxy]phenyl]-phenylsulfonio]phenoxy]ethanesulfonate;2-(4-diphenylsulfonio-2,6-dimethylphenoxy)-1,1-difluoroethanesulfonate;2-(4-diphenylsulfonio-2,6-dimethylphenoxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-[4-(4-diphenylsulfoniophenoxy)benzoyl]oxy-1,1-difluoroethanesulfonate;2-[4-(4-diphenylsulfoniophenoxy)benzoyl]oxy-1,1-difluoropropane-1-sulfonate;2-[5-(4-diphenylsulfoniophenoxy)naphthalene-1-carbonyl]oxy-1,1-difluoroethanesulfonate;2-[6-(4-diphenylsulfoniophenoxy)naphthalene-2-carbonyl]oxy-1,1-difluoroethanesulfonate;2-[5-(4-diphenylsulfoniophenoxy)naphthalene-1-carbonyl]oxy-1,1-difluoropropane-1-sulfonate;2-[6-(4-diphenylsulfoniophenoxy)naphthalene-2-carbonyl]oxy-1,1-difluoropropane-1-sulfonate;1,1,3,3,3-pentafluoro-2-[4-[[4-[(2-methylpropan-2-yl)oxy]phenyl]-phenylsulfonio]phenoxy]propane-1-sulfonate.
What is the SMILES notation for 2-[4-bis[4-[(2-methylpropan-2-yl)oxy]phenyl]sulfoniophenoxy]-1,1-difluoroethanesulfonate;2-[4-bis[4-[(2-methylpropan-2-yl)oxy]phenyl]sulfoniophenoxy]-1,1,3,3,3-pentafluoropropane-1-sulfonate;1,1-difluoro-2-[4-[[4-[(2-methylpropan-2-yl)oxy]phenyl]-phenylsulfonio]phenoxy]ethanesulfonate;2-(4-diphenylsulfonio-2,6-dimethylphenoxy)-1,1-difluoroethanesulfonate;2-(4-diphenylsulfonio-2,6-dimethylphenoxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-[4-(4-diphenylsulfoniophenoxy)benzoyl]oxy-1,1-difluoroethanesulfonate;2-[4-(4-diphenylsulfoniophenoxy)benzoyl]oxy-1,1-difluoropropane-1-sulfonate;2-[5-(4-diphenylsulfoniophenoxy)naphthalene-1-carbonyl]oxy-1,1-difluoroethanesulfonate;2-[6-(4-diphenylsulfoniophenoxy)naphthalene-2-carbonyl]oxy-1,1-difluoroethanesulfonate;2-[5-(4-diphenylsulfoniophenoxy)naphthalene-1-carbonyl]oxy-1,1-difluoropropane-1-sulfonate;2-[6-(4-diphenylsulfoniophenoxy)naphthalene-2-carbonyl]oxy-1,1-difluoropropane-1-sulfonate;1,1,3,3,3-pentafluoro-2-[4-[[4-[(2-methylpropan-2-yl)oxy]phenyl]-phenylsulfonio]phenoxy]propane-1-sulfonate?
The canonical SMILES for 2-[4-bis[4-[(2-methylpropan-2-yl)oxy]phenyl]sulfoniophenoxy]-1,1-difluoroethanesulfonate;2-[4-bis[4-[(2-methylpropan-2-yl)oxy]phenyl]sulfoniophenoxy]-1,1,3,3,3-pentafluoropropane-1-sulfonate;1,1-difluoro-2-[4-[[4-[(2-methylpropan-2-yl)oxy]phenyl]-phenylsulfonio]phenoxy]ethanesulfonate;2-(4-diphenylsulfonio-2,6-dimethylphenoxy)-1,1-difluoroethanesulfonate;2-(4-diphenylsulfonio-2,6-dimethylphenoxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-[4-(4-diphenylsulfoniophenoxy)benzoyl]oxy-1,1-difluoroethanesulfonate;2-[4-(4-diphenylsulfoniophenoxy)benzoyl]oxy-1,1-difluoropropane-1-sulfonate;2-[5-(4-diphenylsulfoniophenoxy)naphthalene-1-carbonyl]oxy-1,1-difluoroethanesulfonate;2-[6-(4-diphenylsulfoniophenoxy)naphthalene-2-carbonyl]oxy-1,1-difluoroethanesulfonate;2-[5-(4-diphenylsulfoniophenoxy)naphthalene-1-carbonyl]oxy-1,1-difluoropropane-1-sulfonate;2-[6-(4-diphenylsulfoniophenoxy)naphthalene-2-carbonyl]oxy-1,1-difluoropropane-1-sulfonate;1,1,3,3,3-pentafluoro-2-[4-[[4-[(2-methylpropan-2-yl)oxy]phenyl]-phenylsulfonio]phenoxy]propane-1-sulfonate is CC(C)(C)Oc1ccc([S+](c2ccc(OC(C(F)(F)F)C(F)(F)S(=O)(=O)[O-])cc2)c2ccc(OC(C)(C)C)cc2)cc1.CC(C)(C)Oc1ccc([S+](c2ccc(OCC(F)(F)S(=O)(=O)[O-])cc2)c2ccc(OC(C)(C)C)cc2)cc1.CC(C)(C)Oc1ccc([S+](c2ccccc2)c2ccc(OC(C(F)(F)F)C(F)(F)S(=O)(=O)[O-])cc2)cc1.CC(C)(C)Oc1ccc([S+](c2ccccc2)c2ccc(OCC(F)(F)S(=O)(=O)[O-])cc2)cc1.CC(OC(=O)c1ccc(Oc2ccc([S+](c3ccccc3)c3ccccc3)cc2)cc1)C(F)(F)S(=O)(=O)[O-].CC(OC(=O)c1ccc2cc(Oc3ccc([S+](c4ccccc4)c4ccccc4)cc3)ccc2c1)C(F)(F)S(=O)(=O)[O-].CC(OC(=O)c1cccc2c(Oc3ccc([S+](c4ccccc4)c4ccccc4)cc3)cccc12)C(F)(F)S(=O)(=O)[O-].Cc1cc([S+](c2ccccc2)c2ccccc2)cc(C)c1OC(C(F)(F)F)C(F)(F)S(=O)(=O)[O-].Cc1cc([S+](c2ccccc2)c2ccccc2)cc(C)c1OCC(F)(F)S(=O)(=O)[O-].O=C(OCC(F)(F)S(=O)(=O)[O-])c1ccc(Oc2ccc([S+](c3ccccc3)c3ccccc3)cc2)cc1.O=C(OCC(F)(F)S(=O)(=O)[O-])c1ccc2cc(Oc3ccc([S+](c4ccccc4)c4ccccc4)cc3)ccc2c1.O=C(OCC(F)(F)S(=O)(=O)[O-])c1cccc2c(Oc3ccc([S+](c4ccccc4)c4ccccc4)cc3)cccc12.
What is the InChIKey of 2-[4-bis[4-[(2-methylpropan-2-yl)oxy]phenyl]sulfoniophenoxy]-1,1-difluoroethanesulfonate;2-[4-bis[4-[(2-methylpropan-2-yl)oxy]phenyl]sulfoniophenoxy]-1,1,3,3,3-pentafluoropropane-1-sulfonate;1,1-difluoro-2-[4-[[4-[(2-methylpropan-2-yl)oxy]phenyl]-phenylsulfonio]phenoxy]ethanesulfonate;2-(4-diphenylsulfonio-2,6-dimethylphenoxy)-1,1-difluoroethanesulfonate;2-(4-diphenylsulfonio-2,6-dimethylphenoxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-[4-(4-diphenylsulfoniophenoxy)benzoyl]oxy-1,1-difluoroethanesulfonate;2-[4-(4-diphenylsulfoniophenoxy)benzoyl]oxy-1,1-difluoropropane-1-sulfonate;2-[5-(4-diphenylsulfoniophenoxy)naphthalene-1-carbonyl]oxy-1,1-difluoroethanesulfonate;2-[6-(4-diphenylsulfoniophenoxy)naphthalene-2-carbonyl]oxy-1,1-difluoroethanesulfonate;2-[5-(4-diphenylsulfoniophenoxy)naphthalene-1-carbonyl]oxy-1,1-difluoropropane-1-sulfonate;2-[6-(4-diphenylsulfoniophenoxy)naphthalene-2-carbonyl]oxy-1,1-difluoropropane-1-sulfonate;1,1,3,3,3-pentafluoro-2-[4-[[4-[(2-methylpropan-2-yl)oxy]phenyl]-phenylsulfonio]phenoxy]propane-1-sulfonate?
The InChIKey is BSIWPSGCXFPYDO-UHFFFAOYSA-N. The full InChI is InChI=1S/2C32H24F2O6S2.2C31H22F2O6S2.C29H31F5O6S2.C28H22F2O6S2.C28H32F2O6S2.C27H20F2O6S2.C25H23F5O5S2.C24H24F2O5S2.C23H19F5O4S2.C22H20F2O4S2/c1-22(32(33,34)42(36,37)38)39-31(35)29-16-8-15-28-27(29)14-9-17-30(28)40-23-18-20-26(21-19-23)41(24-10-4-2-5-11-24)25-12-6-3-7-13-25;1-22(32(33,34)42(36,37)38)39-31(35)25-13-12-24-21-27(15-14-23(24)20-25)40-26-16-18-30(19-17-26)41(28-8-4-2-5-9-28)29-10-6-3-7-11-29;32-31(33,41(35,36)37)21-38-30(34)28-15-7-14-27-26(28)13-8-16-29(27)39-22-17-19-25(20-18-22)40(23-9-3-1-4-10-23)24-11-5-2-6-12-24;32-31(33,41(35,36)37)21-38-30(34)24-12-11-23-20-26(14-13-22(23)19-24)39-25-15-17-29(18-16-25)40(27-7-3-1-4-8-27)28-9-5-2-6-10-28;1-26(2,3)39-20-9-15-23(16-10-20)41(24-17-11-21(12-18-24)40-27(4,5)6)22-13-7-19(8-14-22)38-25(28(30,31)32)29(33,34)42(35,36)37;1-20(28(29,30)38(32,33)34)35-27(31)21-12-14-22(15-13-21)36-23-16-18-26(19-17-23)37(24-8-4-2-5-9-24)25-10-6-3-7-11-25;1-26(2,3)35-21-9-15-24(16-10-21)37(25-17-11-22(12-18-25)36-27(4,5)6)23-13-7-20(8-14-23)34-19-28(29,30)38(31,32)33;28-27(29,37(31,32)33)19-34-26(30)20-11-13-21(14-12-20)35-22-15-17-25(18-16-22)36(23-7-3-1-4-8-23)24-9-5-2-6-10-24;1-23(2,3)35-18-11-15-21(16-12-18)36(19-7-5-4-6-8-19)20-13-9-17(10-14-20)34-22(24(26,27)28)25(29,30)37(31,32)33;1-23(2,3)31-19-11-15-22(16-12-19)32(20-7-5-4-6-8-20)21-13-9-18(10-14-21)30-17-24(25,26)33(27,28)29;1-15-13-19(33(17-9-5-3-6-10-17)18-11-7-4-8-12-18)14-16(2)20(15)32-21(22(24,25)26)23(27,28)34(29,30)31;1-16-13-20(14-17(2)21(16)28-15-22(23,24)30(25,26)27)29(18-9-5-3-6-10-18)19-11-7-4-8-12-19/h2*2-22H,1H3;2*1-20H,21H2;7-18,25H,1-6H3;2-20H,1H3;7-18H,19H2,1-6H3;1-18H,19H2;4-16,22H,1-3H3;4-16H,17H2,1-3H3;3-14,21H,1-2H3;3-14H,15H2,1-2H3.
What are the key properties of 2-[4-bis[4-[(2-methylpropan-2-yl)oxy]phenyl]sulfoniophenoxy]-1,1-difluoroethanesulfonate;2-[4-bis[4-[(2-methylpropan-2-yl)oxy]phenyl]sulfoniophenoxy]-1,1,3,3,3-pentafluoropropane-1-sulfonate;1,1-difluoro-2-[4-[[4-[(2-methylpropan-2-yl)oxy]phenyl]-phenylsulfonio]phenoxy]ethanesulfonate;2-(4-diphenylsulfonio-2,6-dimethylphenoxy)-1,1-difluoroethanesulfonate;2-(4-diphenylsulfonio-2,6-dimethylphenoxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-[4-(4-diphenylsulfoniophenoxy)benzoyl]oxy-1,1-difluoroethanesulfonate;2-[4-(4-diphenylsulfoniophenoxy)benzoyl]oxy-1,1-difluoropropane-1-sulfonate;2-[5-(4-diphenylsulfoniophenoxy)naphthalene-1-carbonyl]oxy-1,1-difluoroethanesulfonate;2-[6-(4-diphenylsulfoniophenoxy)naphthalene-2-carbonyl]oxy-1,1-difluoroethanesulfonate;2-[5-(4-diphenylsulfoniophenoxy)naphthalene-1-carbonyl]oxy-1,1-difluoropropane-1-sulfonate;2-[6-(4-diphenylsulfoniophenoxy)naphthalene-2-carbonyl]oxy-1,1-difluoropropane-1-sulfonate;1,1,3,3,3-pentafluoro-2-[4-[[4-[(2-methylpropan-2-yl)oxy]phenyl]-phenylsulfonio]phenoxy]propane-1-sulfonate?
2-[4-bis[4-[(2-methylpropan-2-yl)oxy]phenyl]sulfoniophenoxy]-1,1-difluoroethanesulfonate;2-[4-bis[4-[(2-methylpropan-2-yl)oxy]phenyl]sulfoniophenoxy]-1,1,3,3,3-pentafluoropropane-1-sulfonate;1,1-difluoro-2-[4-[[4-[(2-methylpropan-2-yl)oxy]phenyl]-phenylsulfonio]phenoxy]ethanesulfonate;2-(4-diphenylsulfonio-2,6-dimethylphenoxy)-1,1-difluoroethanesulfonate;2-(4-diphenylsulfonio-2,6-dimethylphenoxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-[4-(4-diphenylsulfoniophenoxy)benzoyl]oxy-1,1-difluoroethanesulfonate;2-[4-(4-diphenylsulfoniophenoxy)benzoyl]oxy-1,1-difluoropropane-1-sulfonate;2-[5-(4-diphenylsulfoniophenoxy)naphthalene-1-carbonyl]oxy-1,1-difluoroethanesulfonate;2-[6-(4-diphenylsulfoniophenoxy)naphthalene-2-carbonyl]oxy-1,1-difluoroethanesulfonate;2-[5-(4-diphenylsulfoniophenoxy)naphthalene-1-carbonyl]oxy-1,1-difluoropropane-1-sulfonate;2-[6-(4-diphenylsulfoniophenoxy)naphthalene-2-carbonyl]oxy-1,1-difluoropropane-1-sulfonate;1,1,3,3,3-pentafluoro-2-[4-[[4-[(2-methylpropan-2-yl)oxy]phenyl]-phenylsulfonio]phenoxy]propane-1-sulfonate has a molecular weight of 6725.39 g/mol, XLogP of 77.88, 102 rotatable bonds, 0 hydrogen bond donors, and 66 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-bis[4-[(2-methylpropan-2-yl)oxy]phenyl]sulfoniophenoxy]-1,1-difluoroethanesulfonate;2-[4-bis[4-[(2-methylpropan-2-yl)oxy]phenyl]sulfoniophenoxy]-1,1,3,3,3-pentafluoropropane-1-sulfonate;1,1-difluoro-2-[4-[[4-[(2-methylpropan-2-yl)oxy]phenyl]-phenylsulfonio]phenoxy]ethanesulfonate;2-(4-diphenylsulfonio-2,6-dimethylphenoxy)-1,1-difluoroethanesulfonate;2-(4-diphenylsulfonio-2,6-dimethylphenoxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-[4-(4-diphenylsulfoniophenoxy)benzoyl]oxy-1,1-difluoroethanesulfonate;2-[4-(4-diphenylsulfoniophenoxy)benzoyl]oxy-1,1-difluoropropane-1-sulfonate;2-[5-(4-diphenylsulfoniophenoxy)naphthalene-1-carbonyl]oxy-1,1-difluoroethanesulfonate;2-[6-(4-diphenylsulfoniophenoxy)naphthalene-2-carbonyl]oxy-1,1-difluoroethanesulfonate;2-[5-(4-diphenylsulfoniophenoxy)naphthalene-1-carbonyl]oxy-1,1-difluoropropane-1-sulfonate;2-[6-(4-diphenylsulfoniophenoxy)naphthalene-2-carbonyl]oxy-1,1-difluoropropane-1-sulfonate;1,1,3,3,3-pentafluoro-2-[4-[[4-[(2-methylpropan-2-yl)oxy]phenyl]-phenylsulfonio]phenoxy]propane-1-sulfonate is sourced from PubChem (CID 157447152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).