[4-(2-bicyclo[2.2.1]heptanyloxy)phenyl]-diphenylsulfanium;2-[4-(4-diphenylsulfoniophenoxy)adamantane-1-carbonyl]oxy-1,1-difluoropropane-1-sulfonate;2-[4-(4-diphenylsulfoniophenoxy)cyclohexanecarbonyl]oxy-1,1-difluoropropane-1-sulfonate;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;4-(4-diphenylsulfoniophenoxy)-1,1,2,2-tetrafluorobutane-1-sulfonate;1,1,2,2-tetrafluoropropane-1-sulfonate

C174H154F16O32S12 — CID 159659633

IUPAC[4-(2-bicyclo[2.2.1]heptanyloxy)phenyl]-diphenylsulfanium;2-[4-(4-diphenylsulfoniophenoxy)adamantane-1-carbonyl]oxy-1,1-difluoropropane-1-sulfonate;2-[4-(4-diphenylsulfoniophenoxy)cyclohexanecarbonyl]oxy-1,1-difluoropropane-1-sulfonate;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;4-(4-diphenylsulfoniophenoxy)-1,1,2,2-tetrafluorobutane-1-sulfonate;1,1,2,2-tetrafluoropropane-1-sulfonate
SMILESCC(F)(F)C(F)(F)S(=O)(=O)[O-].CC(OC(=O)C12CC3CC(C1)C(Oc1ccc([S+](c4ccccc4)c4ccccc4)cc1)C(C3)C2)C(F)(F)S(=O)(=O)[O-].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-].O=S(=O)([O-])C(F)(F)C(F)(F)CCOc1ccc([S+](c2ccccc2)c2ccccc2)cc1.c1ccc([S+](c2ccccc2)c2ccc(OC3CC4CCC3C4)cc2)cc1
InChIInChI=1S/C32H32F2O6S2.2C32H24F2O6S2.C28H28F2O6S2.C25H25OS.C22H18F4O4S2.C3H4F4O3S/c1-21(32(33,34)42(36,37)38)39-30(35)31-18-22-16-23(19-31)29(24(17-22)20-31)40-25-12-14-28(15-13-25)41(26-8-4-2-5-9-26)27-10-6-3-7-11-27;1-22(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;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;1-3-7-22(8-4-1)27(23-9-5-2-6-10-23)24-15-13-21(14-16-24)26-25-18-19-11-12-20(25)17-19;23-21(24,22(25,26)32(27,28)29)15-16-30-17-11-13-20(14-12-17)31(18-7-3-1-4-8-18)19-9-5-2-6-10-19;1-2(4,5)3(6,7)11(8,9)10/h2-15,21-24,29H,16-20H2,1H3;2*2-22H,1H3;2-11,16-22H,12-15H2,1H3;1-10,13-16,19-20,25H,11-12,17-18H2;1-14H,15-16H2;1H3,(H,8,9,10)/q;;;;+1;;/p-1
InChIKeyMSQCBPBODBOCHI-UHFFFAOYSA-M
MW3445.89 g/mol
LogP39.49
Rot. Bonds52

About [4-(2-bicyclo[2.2.1]heptanyloxy)phenyl]-diphenylsulfanium;2-[4-(4-diphenylsulfoniophenoxy)adamantane-1-carbonyl]oxy-1,1-difluoropropane-1-sulfonate;2-[4-(4-diphenylsulfoniophenoxy)cyclohexanecarbonyl]oxy-1,1-difluoropropane-1-sulfonate;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;4-(4-diphenylsulfoniophenoxy)-1,1,2,2-tetrafluorobutane-1-sulfonate;1,1,2,2-tetrafluoropropane-1-sulfonate

[4-(2-bicyclo[2.2.1]heptanyloxy)phenyl]-diphenylsulfanium;2-[4-(4-diphenylsulfoniophenoxy)adamantane-1-carbonyl]oxy-1,1-difluoropropane-1-sulfonate;2-[4-(4-diphenylsulfoniophenoxy)cyclohexanecarbonyl]oxy-1,1-difluoropropane-1-sulfonate;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;4-(4-diphenylsulfoniophenoxy)-1,1,2,2-tetrafluorobutane-1-sulfonate;1,1,2,2-tetrafluoropropane-1-sulfonate (PubChem CID 159659633) has the molecular formula C174H154F16O32S12 and a molecular weight of 3445.89 g/mol. Its IUPAC name is [4-(2-bicyclo[2.2.1]heptanyloxy)phenyl]-diphenylsulfanium;2-[4-(4-diphenylsulfoniophenoxy)adamantane-1-carbonyl]oxy-1,1-difluoropropane-1-sulfonate;2-[4-(4-diphenylsulfoniophenoxy)cyclohexanecarbonyl]oxy-1,1-difluoropropane-1-sulfonate;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;4-(4-diphenylsulfoniophenoxy)-1,1,2,2-tetrafluorobutane-1-sulfonate;1,1,2,2-tetrafluoropropane-1-sulfonate.

Molecular Properties

Compound Name[4-(2-bicyclo[2.2.1]heptanyloxy)phenyl]-diphenylsulfanium;2-[4-(4-diphenylsulfoniophenoxy)adamantane-1-carbonyl]oxy-1,1-difluoropropane-1-sulfonate;2-[4-(4-diphenylsulfoniophenoxy)cyclohexanecarbonyl]oxy-1,1-difluoropropane-1-sulfonate;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;4-(4-diphenylsulfoniophenoxy)-1,1,2,2-tetrafluorobutane-1-sulfonate;1,1,2,2-tetrafluoropropane-1-sulfonate
PubChem CID159659633
Molecular FormulaC174H154F16O32S12
Molecular Weight3445.89 g/mol
Exact Mass3442.68
IUPAC Name[4-(2-bicyclo[2.2.1]heptanyloxy)phenyl]-diphenylsulfanium;2-[4-(4-diphenylsulfoniophenoxy)adamantane-1-carbonyl]oxy-1,1-difluoropropane-1-sulfonate;2-[4-(4-diphenylsulfoniophenoxy)cyclohexanecarbonyl]oxy-1,1-difluoropropane-1-sulfonate;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;4-(4-diphenylsulfoniophenoxy)-1,1,2,2-tetrafluorobutane-1-sulfonate;1,1,2,2-tetrafluoropropane-1-sulfonate
SMILESCC(F)(F)C(F)(F)S(=O)(=O)[O-].CC(OC(=O)C12CC3CC(C1)C(Oc1ccc([S+](c4ccccc4)c4ccccc4)cc1)C(C3)C2)C(F)(F)S(=O)(=O)[O-].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-].O=S(=O)([O-])C(F)(F)C(F)(F)CCOc1ccc([S+](c2ccccc2)c2ccccc2)cc1.c1ccc([S+](c2ccccc2)c2ccc(OC3CC4CCC3C4)cc2)cc1
InChIInChI=1S/C32H32F2O6S2.2C32H24F2O6S2.C28H28F2O6S2.C25H25OS.C22H18F4O4S2.C3H4F4O3S/c1-21(32(33,34)42(36,37)38)39-30(35)31-18-22-16-23(19-31)29(24(17-22)20-31)40-25-12-14-28(15-13-25)41(26-8-4-2-5-9-26)27-10-6-3-7-11-27;1-22(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;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;1-3-7-22(8-4-1)27(23-9-5-2-6-10-23)24-15-13-21(14-16-24)26-25-18-19-11-12-20(25)17-19;23-21(24,22(25,26)32(27,28)29)15-16-30-17-11-13-20(14-12-17)31(18-7-3-1-4-8-18)19-9-5-2-6-10-19;1-2(4,5)3(6,7)11(8,9)10/h2-15,21-24,29H,16-20H2,1H3;2*2-22H,1H3;2-11,16-22H,12-15H2,1H3;1-10,13-16,19-20,25H,11-12,17-18H2;1-14H,15-16H2;1H3,(H,8,9,10)/q;;;;+1;;/p-1
InChIKeyMSQCBPBODBOCHI-UHFFFAOYSA-M
XLogP39.49
TPSA503.78 Ų
H-Bond Donors
H-Bond Acceptors32
Rotatable Bonds52
Heavy Atoms234
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003445.89
LogP ≤ 539.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1032

Computed Properties (RDKit)

Structural Alerts{'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'charged_oxygen_or_sulfur_atoms', 'substructure': 'N/A'}, {'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}, {'alert_name': 'Sulfonic_acid_2', 'substructure': 'N/A'}

Analyze [4-(2-bicyclo[2.2.1]heptanyloxy)phenyl]-diphenylsulfanium;2-[4-(4-diphenylsulfoniophenoxy)adamantane-1-carbonyl]oxy-1,1-difluoropropane-1-sulfonate;2-[4-(4-diphenylsulfoniophenoxy)cyclohexanecarbonyl]oxy-1,1-difluoropropane-1-sulfonate;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;4-(4-diphenylsulfoniophenoxy)-1,1,2,2-tetrafluorobutane-1-sulfonate;1,1,2,2-tetrafluoropropane-1-sulfonate with MolForge

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Related Compounds

5,5-Difluoro-5-(phenylsulfonyl)pentyl 6-(3-((3r,5r,7r)-adamantan-1-yl)-4-methoxyphenyl)-2-naphthoate
CID 163297716
Triphenylsulfonium 1,1,3,3,3-pentafluoro-2-(6-methacryloyloxy-naphthalene-2-carbonyloxy)-propane-1-sulfonate
CID 86639516
[2-[4-(4-Ethylsulfonyl-3-fluorophenoxy)-6-fluoro-3-methylnaphthalen-2-yl]acetyl] 2-[6-fluoro-4-(3-fluoro-4-methylsulfonylphenoxy)-3-methylnaphthalen-2-yl]acetate
CID 91393837
[2-[4-(4-Ethylsulfonylphenoxy)-7-fluoronaphthalen-2-yl]acetyl] 2-[4-(4-ethylsulfonylphenoxy)-6-(trifluoromethoxy)naphthalen-2-yl]acetate
CID 91412117
[1,1,1,3,3-Pentafluoro-3-(triphenyl-lambda4-sulfanyl)oxysulfonylpropan-2-yl] 6-(2-methylprop-2-enoyloxy)naphthalene-2-carboxylate
CID 140157097
2-[6-(4-Diphenylsulfoniophenoxy)naphthalene-2-carbonyl]oxy-1,1-difluoroethanesulfonate
CID 154594436
2-[5-(4-Diphenylsulfoniophenoxy)naphthalene-1-carbonyl]oxy-1,1-difluoroethanesulfonate
CID 154594641
2-[4-(4-Diphenylsulfoniophenoxy)cyclohexanecarbonyl]oxy-1,1-difluoropropane-1-sulfonate;2-[5-(4-diphenylsulfoniophenoxy)naphthalene-1-carbonyl]oxy-1,1-difluoropropane-1-sulfonate
CID 157154254
Ethane;1-[4-[4-[1,1,1,3,3,3-hexafluoro-2-(4-phenylmethoxyphenyl)propan-2-yl]phenoxy]phenyl]sulfonyl-4-methylbenzene;methanesulfonic acid;1-methyl-4-[4-[4-(4-phenylmethoxyphenyl)phenoxy]phenyl]sulfonylbenzene;1-methyl-4-[4-[4-[2-(4-phenylmethoxyphenyl)propan-2-yl]phenoxy]phenyl]sulfonylbenzene;(4-methylphenyl)-[4-(6-phenylmethoxynaphthalen-2-yl)oxyphenyl]methanone;1-[4-(4-methylphenyl)sulfonylphenoxy]-4-phenylmethoxynaphthalene;1-[4-(4-methylphenyl)sulfonylphenoxy]-5-phenylmethoxynaphthalene;2-[4-(4-methylphenyl)sulfonylphenoxy]-6-phenylmethoxynaphthalene;2-[4-(4-methylphenyl)sulfonylphenoxy]-7-phenylmethoxynaphthalene
CID 157177279
2-[2-[2-(Adamantane-1-carbonyloxy)-5-oxo-4-oxatricyclo[4.2.1.03,7]nonane-9-carbonyl]oxyacetyl]oxy-1,1,3,3,3-pentafluoropropane-1-sulfonic acid;2-(2-benzoyloxyacetyl)oxy-1,1-difluoroethanesulfonic acid;2-(2-benzoyloxyacetyl)oxy-1,1,3,3,3-pentafluoropropane-1-sulfonic acid;1,1-difluoro-2-[2-(naphthalene-2-carbonyloxy)acetyl]oxyethanesulfonic acid;1,1-difluoro-2-(2-naphthalen-2-yloxyacetyl)oxyethanesulfonic acid;1,1-difluoro-2-(2-phenoxyacetyl)oxyethanesulfonic acid;1,1,3,3,3-pentafluoro-2-[2-(naphthalene-2-carbonyloxy)acetyl]oxypropane-1-sulfonic acid;1,1,3,3,3-pentafluoro-2-(2-naphthalen-2-yloxyacetyl)oxypropane-1-sulfonic acid;1,1,3,3,3-pentafluoro-2-(2-phenoxyacetyl)oxypropane-1-sulfonic acid
CID 157193381
(4-Tert-butylphenyl)-diphenylsulfanium;tris(2-(3-cyclohexyloxycarbonylbicyclo[2.2.1]heptane-2-carbonyl)oxy-1,1-difluoroethanesulfonate);1,1-difluoro-2-(5-oxo-4-oxatricyclo[4.2.1.03,7]nonane-9-carbonyl)oxyethanesulfonate;[4-[(2-methylpropan-2-yl)oxy]phenyl]-diphenylsulfanium;1-phenyl-2-(thiolan-1-ium-1-yl)ethanone;tris(4-methylphenyl)sulfanium
CID 157268009
1,1-Difluoro-2-[3-(2-methylprop-2-enoyloxy)adamantane-1-carbonyl]oxypropane-1-sulfonate;1,1-difluoro-2-[4-(2-methylprop-2-enoyloxy)benzoyl]oxypropane-1-sulfonate;1,1-difluoro-2-[6-(2-methylprop-2-enoyloxy)bicyclo[2.2.1]heptane-2-carbonyl]oxypropane-1-sulfonate;1,1-difluoro-2-[2-(2-methylprop-2-enoyloxy)-5-oxo-4-oxatricyclo[4.2.1.03,7]nonane-9-carbonyl]oxypropane-1-sulfonate;tetrakis(triphenylsulfanium)
CID 157294201

Frequently Asked Questions

What is the IUPAC name of [4-(2-bicyclo[2.2.1]heptanyloxy)phenyl]-diphenylsulfanium;2-[4-(4-diphenylsulfoniophenoxy)adamantane-1-carbonyl]oxy-1,1-difluoropropane-1-sulfonate;2-[4-(4-diphenylsulfoniophenoxy)cyclohexanecarbonyl]oxy-1,1-difluoropropane-1-sulfonate;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;4-(4-diphenylsulfoniophenoxy)-1,1,2,2-tetrafluorobutane-1-sulfonate;1,1,2,2-tetrafluoropropane-1-sulfonate?
The IUPAC name of [4-(2-bicyclo[2.2.1]heptanyloxy)phenyl]-diphenylsulfanium;2-[4-(4-diphenylsulfoniophenoxy)adamantane-1-carbonyl]oxy-1,1-difluoropropane-1-sulfonate;2-[4-(4-diphenylsulfoniophenoxy)cyclohexanecarbonyl]oxy-1,1-difluoropropane-1-sulfonate;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;4-(4-diphenylsulfoniophenoxy)-1,1,2,2-tetrafluorobutane-1-sulfonate;1,1,2,2-tetrafluoropropane-1-sulfonate (CID 159659633) is [4-(2-bicyclo[2.2.1]heptanyloxy)phenyl]-diphenylsulfanium;2-[4-(4-diphenylsulfoniophenoxy)adamantane-1-carbonyl]oxy-1,1-difluoropropane-1-sulfonate;2-[4-(4-diphenylsulfoniophenoxy)cyclohexanecarbonyl]oxy-1,1-difluoropropane-1-sulfonate;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;4-(4-diphenylsulfoniophenoxy)-1,1,2,2-tetrafluorobutane-1-sulfonate;1,1,2,2-tetrafluoropropane-1-sulfonate.
What is the SMILES notation for [4-(2-bicyclo[2.2.1]heptanyloxy)phenyl]-diphenylsulfanium;2-[4-(4-diphenylsulfoniophenoxy)adamantane-1-carbonyl]oxy-1,1-difluoropropane-1-sulfonate;2-[4-(4-diphenylsulfoniophenoxy)cyclohexanecarbonyl]oxy-1,1-difluoropropane-1-sulfonate;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;4-(4-diphenylsulfoniophenoxy)-1,1,2,2-tetrafluorobutane-1-sulfonate;1,1,2,2-tetrafluoropropane-1-sulfonate?
The canonical SMILES for [4-(2-bicyclo[2.2.1]heptanyloxy)phenyl]-diphenylsulfanium;2-[4-(4-diphenylsulfoniophenoxy)adamantane-1-carbonyl]oxy-1,1-difluoropropane-1-sulfonate;2-[4-(4-diphenylsulfoniophenoxy)cyclohexanecarbonyl]oxy-1,1-difluoropropane-1-sulfonate;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;4-(4-diphenylsulfoniophenoxy)-1,1,2,2-tetrafluorobutane-1-sulfonate;1,1,2,2-tetrafluoropropane-1-sulfonate is CC(F)(F)C(F)(F)S(=O)(=O)[O-].CC(OC(=O)C12CC3CC(C1)C(Oc1ccc([S+](c4ccccc4)c4ccccc4)cc1)C(C3)C2)C(F)(F)S(=O)(=O)[O-].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-].O=S(=O)([O-])C(F)(F)C(F)(F)CCOc1ccc([S+](c2ccccc2)c2ccccc2)cc1.c1ccc([S+](c2ccccc2)c2ccc(OC3CC4CCC3C4)cc2)cc1.
What is the InChIKey of [4-(2-bicyclo[2.2.1]heptanyloxy)phenyl]-diphenylsulfanium;2-[4-(4-diphenylsulfoniophenoxy)adamantane-1-carbonyl]oxy-1,1-difluoropropane-1-sulfonate;2-[4-(4-diphenylsulfoniophenoxy)cyclohexanecarbonyl]oxy-1,1-difluoropropane-1-sulfonate;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;4-(4-diphenylsulfoniophenoxy)-1,1,2,2-tetrafluorobutane-1-sulfonate;1,1,2,2-tetrafluoropropane-1-sulfonate?
The InChIKey is MSQCBPBODBOCHI-UHFFFAOYSA-M. The full InChI is InChI=1S/C32H32F2O6S2.2C32H24F2O6S2.C28H28F2O6S2.C25H25OS.C22H18F4O4S2.C3H4F4O3S/c1-21(32(33,34)42(36,37)38)39-30(35)31-18-22-16-23(19-31)29(24(17-22)20-31)40-25-12-14-28(15-13-25)41(26-8-4-2-5-9-26)27-10-6-3-7-11-27;1-22(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;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;1-3-7-22(8-4-1)27(23-9-5-2-6-10-23)24-15-13-21(14-16-24)26-25-18-19-11-12-20(25)17-19;23-21(24,22(25,26)32(27,28)29)15-16-30-17-11-13-20(14-12-17)31(18-7-3-1-4-8-18)19-9-5-2-6-10-19;1-2(4,5)3(6,7)11(8,9)10/h2-15,21-24,29H,16-20H2,1H3;2*2-22H,1H3;2-11,16-22H,12-15H2,1H3;1-10,13-16,19-20,25H,11-12,17-18H2;1-14H,15-16H2;1H3,(H,8,9,10)/q;;;;+1;;/p-1.
What are the key properties of [4-(2-bicyclo[2.2.1]heptanyloxy)phenyl]-diphenylsulfanium;2-[4-(4-diphenylsulfoniophenoxy)adamantane-1-carbonyl]oxy-1,1-difluoropropane-1-sulfonate;2-[4-(4-diphenylsulfoniophenoxy)cyclohexanecarbonyl]oxy-1,1-difluoropropane-1-sulfonate;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;4-(4-diphenylsulfoniophenoxy)-1,1,2,2-tetrafluorobutane-1-sulfonate;1,1,2,2-tetrafluoropropane-1-sulfonate?
[4-(2-bicyclo[2.2.1]heptanyloxy)phenyl]-diphenylsulfanium;2-[4-(4-diphenylsulfoniophenoxy)adamantane-1-carbonyl]oxy-1,1-difluoropropane-1-sulfonate;2-[4-(4-diphenylsulfoniophenoxy)cyclohexanecarbonyl]oxy-1,1-difluoropropane-1-sulfonate;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;4-(4-diphenylsulfoniophenoxy)-1,1,2,2-tetrafluorobutane-1-sulfonate;1,1,2,2-tetrafluoropropane-1-sulfonate has a molecular weight of 3445.89 g/mol, XLogP of 39.49, 52 rotatable bonds, 0 hydrogen bond donors, and 32 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2-bicyclo[2.2.1]heptanyloxy)phenyl]-diphenylsulfanium;2-[4-(4-diphenylsulfoniophenoxy)adamantane-1-carbonyl]oxy-1,1-difluoropropane-1-sulfonate;2-[4-(4-diphenylsulfoniophenoxy)cyclohexanecarbonyl]oxy-1,1-difluoropropane-1-sulfonate;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;4-(4-diphenylsulfoniophenoxy)-1,1,2,2-tetrafluorobutane-1-sulfonate;1,1,2,2-tetrafluoropropane-1-sulfonate is sourced from PubChem (CID 159659633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).