dinaphthalen-1-yl(phenyl)sulfanium;1,1,2,2,3,3-hexafluoro-3-(naphthalen-1-ylmethoxy)propane-1-sulfonate;1,1,2,2,3,3-hexafluoro-3-phenylmethoxypropane-1-sulfonate;tetrakis((4-methoxy-3,5-dimethylphenyl)-diphenylsulfanium);1,1,2,2-tetrafluoro-2-(naphthalen-1-ylmethoxy)ethanesulfonate;1,1,2,2-tetrafluoro-2-(naphthalen-2-ylmethoxy)ethanesulfonate;1,1,2,2-tetrafluoro-2-phenylmethoxyethanesulfonate

C169H144F24O24S10 — CID 158748323

About dinaphthalen-1-yl(phenyl)sulfanium;1,1,2,2,3,3-hexafluoro-3-(naphthalen-1-ylmethoxy)propane-1-sulfonate;1,1,2,2,3,3-hexafluoro-3-phenylmethoxypropane-1-sulfonate;tetrakis((4-methoxy-3,5-dimethylphenyl)-diphenylsulfanium);1,1,2,2-tetrafluoro-2-(naphthalen-1-ylmethoxy)ethanesulfonate;1,1,2,2-tetrafluoro-2-(naphthalen-2-ylmethoxy)ethanesulfonate;1,1,2,2-tetrafluoro-2-phenylmethoxyethanesulfonate

dinaphthalen-1-yl(phenyl)sulfanium;1,1,2,2,3,3-hexafluoro-3-(naphthalen-1-ylmethoxy)propane-1-sulfonate;1,1,2,2,3,3-hexafluoro-3-phenylmethoxypropane-1-sulfonate;tetrakis((4-methoxy-3,5-dimethylphenyl)-diphenylsulfanium);1,1,2,2-tetrafluoro-2-(naphthalen-1-ylmethoxy)ethanesulfonate;1,1,2,2-tetrafluoro-2-(naphthalen-2-ylmethoxy)ethanesulfonate;1,1,2,2-tetrafluoro-2-phenylmethoxyethanesulfonate (PubChem CID 158748323) has the molecular formula C169H144F24O24S10 and a molecular weight of 3335.61 g/mol. Its IUPAC name is dinaphthalen-1-yl(phenyl)sulfanium;1,1,2,2,3,3-hexafluoro-3-(naphthalen-1-ylmethoxy)propane-1-sulfonate;1,1,2,2,3,3-hexafluoro-3-phenylmethoxypropane-1-sulfonate;tetrakis((4-methoxy-3,5-dimethylphenyl)-diphenylsulfanium);1,1,2,2-tetrafluoro-2-(naphthalen-1-ylmethoxy)ethanesulfonate;1,1,2,2-tetrafluoro-2-(naphthalen-2-ylmethoxy)ethanesulfonate;1,1,2,2-tetrafluoro-2-phenylmethoxyethanesulfonate.

Molecular Properties

• Compound Name: dinaphthalen-1-yl(phenyl)sulfanium;1,1,2,2,3,3-hexafluoro-3-(naphthalen-1-ylmethoxy)propane-1-sulfonate;1,1,2,2,3,3-hexafluoro-3-phenylmethoxypropane-1-sulfonate;tetrakis((4-methoxy-3,5-dimethylphenyl)-diphenylsulfanium);1,1,2,2-tetrafluoro-2-(naphthalen-1-ylmethoxy)ethanesulfonate;1,1,2,2-tetrafluoro-2-(naphthalen-2-ylmethoxy)ethanesulfonate;1,1,2,2-tetrafluoro-2-phenylmethoxyethanesulfonate
• PubChem CID: 158748323
• Molecular Formula: C169H144F24O24S10
• Molecular Weight: 3335.61 g/mol
• Exact Mass: 3332.69
• IUPAC Name: dinaphthalen-1-yl(phenyl)sulfanium;1,1,2,2,3,3-hexafluoro-3-(naphthalen-1-ylmethoxy)propane-1-sulfonate;1,1,2,2,3,3-hexafluoro-3-phenylmethoxypropane-1-sulfonate;tetrakis((4-methoxy-3,5-dimethylphenyl)-diphenylsulfanium);1,1,2,2-tetrafluoro-2-(naphthalen-1-ylmethoxy)ethanesulfonate;1,1,2,2-tetrafluoro-2-(naphthalen-2-ylmethoxy)ethanesulfonate;1,1,2,2-tetrafluoro-2-phenylmethoxyethanesulfonate
• SMILES: COc1c(C)cc([S+](c2ccccc2)c2ccccc2)cc1C.COc1c(C)cc([S+](c2ccccc2)c2ccccc2)cc1C.COc1c(C)cc([S+](c2ccccc2)c2ccccc2)cc1C.COc1c(C)cc([S+](c2ccccc2)c2ccccc2)cc1C.O=S(=O)([O-])C(F)(F)C(F)(F)C(F)(F)OCc1cccc2ccccc12.O=S(=O)([O-])C(F)(F)C(F)(F)C(F)(F)OCc1ccccc1.O=S(=O)([O-])C(F)(F)C(F)(F)OCc1ccc2ccccc2c1.O=S(=O)([O-])C(F)(F)C(F)(F)OCc1cccc2ccccc12.O=S(=O)([O-])C(F)(F)C(F)(F)OCc1ccccc1.c1ccc([S+](c2cccc3ccccc23)c2cccc3ccccc23)cc1
• InChI: InChI=1S/C26H19S.4C21H21OS.C14H10F6O4S.2C13H10F4O4S.C10H8F6O4S.C9H8F4O4S/c1-2-14-22(15-3-1)27(25-18-8-12-20-10-4-6-16-23(20)25)26-19-9-13-21-11-5-7-17-24(21)26;4*1-16-14-20(15-17(2)21(16)22-3)23(18-10-6-4-7-11-18)19-12-8-5-9-13-19;15-12(16,14(19,20)25(21,22)23)13(17,18)24-8-10-6-3-5-9-4-1-2-7-11(9)10;14-12(15,13(16,17)22(18,19)20)21-8-10-6-3-5-9-4-1-2-7-11(9)10;14-12(15,13(16,17)22(18,19)20)21-8-9-5-6-10-3-1-2-4-11(10)7-9;11-8(12,10(15,16)21(17,18)19)9(13,14)20-6-7-4-2-1-3-5-7;10-8(11,9(12,13)18(14,15)16)17-6-7-4-2-1-3-5-7/h1-19H;4*4-15H,1-3H3;1-7H,8H2,(H,21,22,23);2*1-7H,8H2,(H,18,19,20);1-5H,6H2,(H,17,18,19);1-5H,6H2,(H,14,15,16)/q5*+1;;;;;/p-5
• InChIKey: INDPMHPZWRKHQT-UHFFFAOYSA-I
• XLogP: 43.12
• TPSA: 369.07 Ų
• H-Bond Acceptors: 24
• Rotatable Bonds: 46
• Heavy Atoms: 227
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3335.61
LogP ≤ 5	43.12
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	24

Computed Properties (RDKit)

• Structural Alerts: {'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'}

Frequently Asked Questions

What is the IUPAC name of dinaphthalen-1-yl(phenyl)sulfanium;1,1,2,2,3,3-hexafluoro-3-(naphthalen-1-ylmethoxy)propane-1-sulfonate;1,1,2,2,3,3-hexafluoro-3-phenylmethoxypropane-1-sulfonate;tetrakis((4-methoxy-3,5-dimethylphenyl)-diphenylsulfanium);1,1,2,2-tetrafluoro-2-(naphthalen-1-ylmethoxy)ethanesulfonate;1,1,2,2-tetrafluoro-2-(naphthalen-2-ylmethoxy)ethanesulfonate;1,1,2,2-tetrafluoro-2-phenylmethoxyethanesulfonate?

The IUPAC name of dinaphthalen-1-yl(phenyl)sulfanium;1,1,2,2,3,3-hexafluoro-3-(naphthalen-1-ylmethoxy)propane-1-sulfonate;1,1,2,2,3,3-hexafluoro-3-phenylmethoxypropane-1-sulfonate;tetrakis((4-methoxy-3,5-dimethylphenyl)-diphenylsulfanium);1,1,2,2-tetrafluoro-2-(naphthalen-1-ylmethoxy)ethanesulfonate;1,1,2,2-tetrafluoro-2-(naphthalen-2-ylmethoxy)ethanesulfonate;1,1,2,2-tetrafluoro-2-phenylmethoxyethanesulfonate (CID 158748323) is dinaphthalen-1-yl(phenyl)sulfanium;1,1,2,2,3,3-hexafluoro-3-(naphthalen-1-ylmethoxy)propane-1-sulfonate;1,1,2,2,3,3-hexafluoro-3-phenylmethoxypropane-1-sulfonate;tetrakis((4-methoxy-3,5-dimethylphenyl)-diphenylsulfanium);1,1,2,2-tetrafluoro-2-(naphthalen-1-ylmethoxy)ethanesulfonate;1,1,2,2-tetrafluoro-2-(naphthalen-2-ylmethoxy)ethanesulfonate;1,1,2,2-tetrafluoro-2-phenylmethoxyethanesulfonate.

What is the SMILES notation for dinaphthalen-1-yl(phenyl)sulfanium;1,1,2,2,3,3-hexafluoro-3-(naphthalen-1-ylmethoxy)propane-1-sulfonate;1,1,2,2,3,3-hexafluoro-3-phenylmethoxypropane-1-sulfonate;tetrakis((4-methoxy-3,5-dimethylphenyl)-diphenylsulfanium);1,1,2,2-tetrafluoro-2-(naphthalen-1-ylmethoxy)ethanesulfonate;1,1,2,2-tetrafluoro-2-(naphthalen-2-ylmethoxy)ethanesulfonate;1,1,2,2-tetrafluoro-2-phenylmethoxyethanesulfonate?

The canonical SMILES for dinaphthalen-1-yl(phenyl)sulfanium;1,1,2,2,3,3-hexafluoro-3-(naphthalen-1-ylmethoxy)propane-1-sulfonate;1,1,2,2,3,3-hexafluoro-3-phenylmethoxypropane-1-sulfonate;tetrakis((4-methoxy-3,5-dimethylphenyl)-diphenylsulfanium);1,1,2,2-tetrafluoro-2-(naphthalen-1-ylmethoxy)ethanesulfonate;1,1,2,2-tetrafluoro-2-(naphthalen-2-ylmethoxy)ethanesulfonate;1,1,2,2-tetrafluoro-2-phenylmethoxyethanesulfonate is COc1c(C)cc([S+](c2ccccc2)c2ccccc2)cc1C.COc1c(C)cc([S+](c2ccccc2)c2ccccc2)cc1C.COc1c(C)cc([S+](c2ccccc2)c2ccccc2)cc1C.COc1c(C)cc([S+](c2ccccc2)c2ccccc2)cc1C.O=S(=O)([O-])C(F)(F)C(F)(F)C(F)(F)OCc1cccc2ccccc12.O=S(=O)([O-])C(F)(F)C(F)(F)C(F)(F)OCc1ccccc1.O=S(=O)([O-])C(F)(F)C(F)(F)OCc1ccc2ccccc2c1.O=S(=O)([O-])C(F)(F)C(F)(F)OCc1cccc2ccccc12.O=S(=O)([O-])C(F)(F)C(F)(F)OCc1ccccc1.c1ccc([S+](c2cccc3ccccc23)c2cccc3ccccc23)cc1.

What is the InChIKey of dinaphthalen-1-yl(phenyl)sulfanium;1,1,2,2,3,3-hexafluoro-3-(naphthalen-1-ylmethoxy)propane-1-sulfonate;1,1,2,2,3,3-hexafluoro-3-phenylmethoxypropane-1-sulfonate;tetrakis((4-methoxy-3,5-dimethylphenyl)-diphenylsulfanium);1,1,2,2-tetrafluoro-2-(naphthalen-1-ylmethoxy)ethanesulfonate;1,1,2,2-tetrafluoro-2-(naphthalen-2-ylmethoxy)ethanesulfonate;1,1,2,2-tetrafluoro-2-phenylmethoxyethanesulfonate?

The InChIKey is INDPMHPZWRKHQT-UHFFFAOYSA-I. The full InChI is InChI=1S/C26H19S.4C21H21OS.C14H10F6O4S.2C13H10F4O4S.C10H8F6O4S.C9H8F4O4S/c1-2-14-22(15-3-1)27(25-18-8-12-20-10-4-6-16-23(20)25)26-19-9-13-21-11-5-7-17-24(21)26;4*1-16-14-20(15-17(2)21(16)22-3)23(18-10-6-4-7-11-18)19-12-8-5-9-13-19;15-12(16,14(19,20)25(21,22)23)13(17,18)24-8-10-6-3-5-9-4-1-2-7-11(9)10;14-12(15,13(16,17)22(18,19)20)21-8-10-6-3-5-9-4-1-2-7-11(9)10;14-12(15,13(16,17)22(18,19)20)21-8-9-5-6-10-3-1-2-4-11(10)7-9;11-8(12,10(15,16)21(17,18)19)9(13,14)20-6-7-4-2-1-3-5-7;10-8(11,9(12,13)18(14,15)16)17-6-7-4-2-1-3-5-7/h1-19H;4*4-15H,1-3H3;1-7H,8H2,(H,21,22,23);2*1-7H,8H2,(H,18,19,20);1-5H,6H2,(H,17,18,19);1-5H,6H2,(H,14,15,16)/q5*+1;;;;;/p-5.

What are the key properties of dinaphthalen-1-yl(phenyl)sulfanium;1,1,2,2,3,3-hexafluoro-3-(naphthalen-1-ylmethoxy)propane-1-sulfonate;1,1,2,2,3,3-hexafluoro-3-phenylmethoxypropane-1-sulfonate;tetrakis((4-methoxy-3,5-dimethylphenyl)-diphenylsulfanium);1,1,2,2-tetrafluoro-2-(naphthalen-1-ylmethoxy)ethanesulfonate;1,1,2,2-tetrafluoro-2-(naphthalen-2-ylmethoxy)ethanesulfonate;1,1,2,2-tetrafluoro-2-phenylmethoxyethanesulfonate?

dinaphthalen-1-yl(phenyl)sulfanium;1,1,2,2,3,3-hexafluoro-3-(naphthalen-1-ylmethoxy)propane-1-sulfonate;1,1,2,2,3,3-hexafluoro-3-phenylmethoxypropane-1-sulfonate;tetrakis((4-methoxy-3,5-dimethylphenyl)-diphenylsulfanium);1,1,2,2-tetrafluoro-2-(naphthalen-1-ylmethoxy)ethanesulfonate;1,1,2,2-tetrafluoro-2-(naphthalen-2-ylmethoxy)ethanesulfonate;1,1,2,2-tetrafluoro-2-phenylmethoxyethanesulfonate has a molecular weight of 3335.61 g/mol, XLogP of 43.12, 46 rotatable bonds, 0 hydrogen bond donors, and 24 hydrogen bond acceptors.

Where does this data come from?

All data for dinaphthalen-1-yl(phenyl)sulfanium;1,1,2,2,3,3-hexafluoro-3-(naphthalen-1-ylmethoxy)propane-1-sulfonate;1,1,2,2,3,3-hexafluoro-3-phenylmethoxypropane-1-sulfonate;tetrakis((4-methoxy-3,5-dimethylphenyl)-diphenylsulfanium);1,1,2,2-tetrafluoro-2-(naphthalen-1-ylmethoxy)ethanesulfonate;1,1,2,2-tetrafluoro-2-(naphthalen-2-ylmethoxy)ethanesulfonate;1,1,2,2-tetrafluoro-2-phenylmethoxyethanesulfonate is sourced from PubChem (CID 158748323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).