bis(4-hexylphenyl)iodanium;bis(4-octylphenyl)iodanium;dibutyl-(3,3-dimethyl-2-oxobutyl)sulfanium;dibutyl(2-oxobutyl)sulfanium;3,3-dimethyl-1-(1,4-oxathian-4-ium-4-yl)butan-2-one;dimethyl(2-oxopropyl)sulfanium;3,3-dimethyl-1-(thian-1-ium-1-yl)butan-2-one;3,3-dimethyl-1-(thiolan-1-ium-1-yl)butan-2-one;ethyl-methyl-(2-oxopropyl)sulfanium;1-(1,4-oxathian-4-ium-4-yl)butan-2-one;2-(1,4-oxathian-4-ium-4-yl)-1-phenylethanone;1-phenyl-2-(thian-1-ium-1-yl)ethanone;1-phenyl-2-(thiolan-1-ium-1-yl)ethanone;1-(thian-1-ium-1-yl)butan-2-one;1-(thiolan-1-ium-1-yl)butan-2-one;1-(thiolan-1-ium-1-yl)propan-2-one

C189H320I2O17S14+16 — CID 157194687

IUPACbis(4-hexylphenyl)iodanium;bis(4-octylphenyl)iodanium;dibutyl-(3,3-dimethyl-2-oxobutyl)sulfanium;dibutyl(2-oxobutyl)sulfanium;3,3-dimethyl-1-(1,4-oxathian-4-ium-4-yl)butan-2-one;dimethyl(2-oxopropyl)sulfanium;3,3-dimethyl-1-(thian-1-ium-1-yl)butan-2-one;3,3-dimethyl-1-(thiolan-1-ium-1-yl)butan-2-one;ethyl-methyl-(2-oxopropyl)sulfanium;1-(1,4-oxathian-4-ium-4-yl)butan-2-one;2-(1,4-oxathian-4-ium-4-yl)-1-phenylethanone;1-phenyl-2-(thian-1-ium-1-yl)ethanone;1-phenyl-2-(thiolan-1-ium-1-yl)ethanone;1-(thian-1-ium-1-yl)butan-2-one;1-(thiolan-1-ium-1-yl)butan-2-one;1-(thiolan-1-ium-1-yl)propan-2-one
SMILESCC(=O)C[S+](C)C.CC(=O)C[S+]1CCCC1.CC(C)(C)C(=O)C[S+]1CCCC1.CC(C)(C)C(=O)C[S+]1CCCCC1.CC(C)(C)C(=O)C[S+]1CCOCC1.CCC(=O)C[S+]1CCCC1.CCC(=O)C[S+]1CCCCC1.CCC(=O)C[S+]1CCOCC1.CCCCCCCCc1ccc([I+]c2ccc(CCCCCCCC)cc2)cc1.CCCCCCc1ccc([I+]c2ccc(CCCCCC)cc2)cc1.CCCC[S+](CCCC)CC(=O)C(C)(C)C.CCCC[S+](CCCC)CC(=O)CC.CC[S+](C)CC(C)=O.O=C(C[S+]1CCCC1)c1ccccc1.O=C(C[S+]1CCCCC1)c1ccccc1.O=C(C[S+]1CCOCC1)c1ccccc1
InChIInChI=1S/C28H42I.C24H34I.C14H29OS.C13H17OS.C12H15O2S.C12H15OS.C12H25OS.C11H21OS.C10H19O2S.C10H19OS.C9H17OS.C8H15O2S.C8H15OS.C7H13OS.C6H13OS.C5H11OS/c1-3-5-7-9-11-13-15-25-17-21-27(22-18-25)29-28-23-19-26(20-24-28)16-14-12-10-8-6-4-2;1-3-5-7-9-11-21-13-17-23(18-14-21)25-24-19-15-22(16-20-24)12-10-8-6-4-2;1-6-8-10-16(11-9-7-2)12-13(15)14(3,4)5;14-13(12-7-3-1-4-8-12)11-15-9-5-2-6-10-15;13-12(11-4-2-1-3-5-11)10-15-8-6-14-7-9-15;13-12(10-14-8-4-5-9-14)11-6-2-1-3-7-11;1-4-7-9-14(10-8-5-2)11-12(13)6-3;1-11(2,3)10(12)9-13-7-5-4-6-8-13;1-10(2,3)9(11)8-13-6-4-12-5-7-13;1-10(2,3)9(11)8-12-6-4-5-7-12;1-2-9(10)8-11-6-4-3-5-7-11;1-2-8(9)7-11-5-3-10-4-6-11;1-2-8(9)7-10-5-3-4-6-10;1-7(8)6-9-4-2-3-5-9;1-4-8(3)5-6(2)7;1-5(6)4-7(2)3/h17-24H,3-16H2,1-2H3;13-20H,3-12H2,1-2H3;6-12H2,1-5H3;1,3-4,7-8H,2,5-6,9-11H2;1-5H,6-10H2;1-3,6-7H,4-5,8-10H2;4-11H2,1-3H3;4-9H2,1-3H3;4-8H2,1-3H3;4-8H2,1-3H3;2-8H2,1H3;2-7H2,1H3;2-7H2,1H3;2-6H2,1H3;4-5H2,1-3H3;4H2,1-3H3/q16*+1
InChIKeyAQCKVRJZEMXQPH-UHFFFAOYSA-N
MW3567.37 g/mol
LogP34.87
Rot. Bonds76

About bis(4-hexylphenyl)iodanium;bis(4-octylphenyl)iodanium;dibutyl-(3,3-dimethyl-2-oxobutyl)sulfanium;dibutyl(2-oxobutyl)sulfanium;3,3-dimethyl-1-(1,4-oxathian-4-ium-4-yl)butan-2-one;dimethyl(2-oxopropyl)sulfanium;3,3-dimethyl-1-(thian-1-ium-1-yl)butan-2-one;3,3-dimethyl-1-(thiolan-1-ium-1-yl)butan-2-one;ethyl-methyl-(2-oxopropyl)sulfanium;1-(1,4-oxathian-4-ium-4-yl)butan-2-one;2-(1,4-oxathian-4-ium-4-yl)-1-phenylethanone;1-phenyl-2-(thian-1-ium-1-yl)ethanone;1-phenyl-2-(thiolan-1-ium-1-yl)ethanone;1-(thian-1-ium-1-yl)butan-2-one;1-(thiolan-1-ium-1-yl)butan-2-one;1-(thiolan-1-ium-1-yl)propan-2-one

bis(4-hexylphenyl)iodanium;bis(4-octylphenyl)iodanium;dibutyl-(3,3-dimethyl-2-oxobutyl)sulfanium;dibutyl(2-oxobutyl)sulfanium;3,3-dimethyl-1-(1,4-oxathian-4-ium-4-yl)butan-2-one;dimethyl(2-oxopropyl)sulfanium;3,3-dimethyl-1-(thian-1-ium-1-yl)butan-2-one;3,3-dimethyl-1-(thiolan-1-ium-1-yl)butan-2-one;ethyl-methyl-(2-oxopropyl)sulfanium;1-(1,4-oxathian-4-ium-4-yl)butan-2-one;2-(1,4-oxathian-4-ium-4-yl)-1-phenylethanone;1-phenyl-2-(thian-1-ium-1-yl)ethanone;1-phenyl-2-(thiolan-1-ium-1-yl)ethanone;1-(thian-1-ium-1-yl)butan-2-one;1-(thiolan-1-ium-1-yl)butan-2-one;1-(thiolan-1-ium-1-yl)propan-2-one (PubChem CID 157194687) has the molecular formula C189H320I2O17S14+16 and a molecular weight of 3567.37 g/mol. Its IUPAC name is bis(4-hexylphenyl)iodanium;bis(4-octylphenyl)iodanium;dibutyl-(3,3-dimethyl-2-oxobutyl)sulfanium;dibutyl(2-oxobutyl)sulfanium;3,3-dimethyl-1-(1,4-oxathian-4-ium-4-yl)butan-2-one;dimethyl(2-oxopropyl)sulfanium;3,3-dimethyl-1-(thian-1-ium-1-yl)butan-2-one;3,3-dimethyl-1-(thiolan-1-ium-1-yl)butan-2-one;ethyl-methyl-(2-oxopropyl)sulfanium;1-(1,4-oxathian-4-ium-4-yl)butan-2-one;2-(1,4-oxathian-4-ium-4-yl)-1-phenylethanone;1-phenyl-2-(thian-1-ium-1-yl)ethanone;1-phenyl-2-(thiolan-1-ium-1-yl)ethanone;1-(thian-1-ium-1-yl)butan-2-one;1-(thiolan-1-ium-1-yl)butan-2-one;1-(thiolan-1-ium-1-yl)propan-2-one.

Molecular Properties

Compound Namebis(4-hexylphenyl)iodanium;bis(4-octylphenyl)iodanium;dibutyl-(3,3-dimethyl-2-oxobutyl)sulfanium;dibutyl(2-oxobutyl)sulfanium;3,3-dimethyl-1-(1,4-oxathian-4-ium-4-yl)butan-2-one;dimethyl(2-oxopropyl)sulfanium;3,3-dimethyl-1-(thian-1-ium-1-yl)butan-2-one;3,3-dimethyl-1-(thiolan-1-ium-1-yl)butan-2-one;ethyl-methyl-(2-oxopropyl)sulfanium;1-(1,4-oxathian-4-ium-4-yl)butan-2-one;2-(1,4-oxathian-4-ium-4-yl)-1-phenylethanone;1-phenyl-2-(thian-1-ium-1-yl)ethanone;1-phenyl-2-(thiolan-1-ium-1-yl)ethanone;1-(thian-1-ium-1-yl)butan-2-one;1-(thiolan-1-ium-1-yl)butan-2-one;1-(thiolan-1-ium-1-yl)propan-2-one
PubChem CID157194687
Molecular FormulaC189H320I2O17S14+16
Molecular Weight3567.37 g/mol
Exact Mass3563.83
IUPAC Namebis(4-hexylphenyl)iodanium;bis(4-octylphenyl)iodanium;dibutyl-(3,3-dimethyl-2-oxobutyl)sulfanium;dibutyl(2-oxobutyl)sulfanium;3,3-dimethyl-1-(1,4-oxathian-4-ium-4-yl)butan-2-one;dimethyl(2-oxopropyl)sulfanium;3,3-dimethyl-1-(thian-1-ium-1-yl)butan-2-one;3,3-dimethyl-1-(thiolan-1-ium-1-yl)butan-2-one;ethyl-methyl-(2-oxopropyl)sulfanium;1-(1,4-oxathian-4-ium-4-yl)butan-2-one;2-(1,4-oxathian-4-ium-4-yl)-1-phenylethanone;1-phenyl-2-(thian-1-ium-1-yl)ethanone;1-phenyl-2-(thiolan-1-ium-1-yl)ethanone;1-(thian-1-ium-1-yl)butan-2-one;1-(thiolan-1-ium-1-yl)butan-2-one;1-(thiolan-1-ium-1-yl)propan-2-one
SMILESCC(=O)C[S+](C)C.CC(=O)C[S+]1CCCC1.CC(C)(C)C(=O)C[S+]1CCCC1.CC(C)(C)C(=O)C[S+]1CCCCC1.CC(C)(C)C(=O)C[S+]1CCOCC1.CCC(=O)C[S+]1CCCC1.CCC(=O)C[S+]1CCCCC1.CCC(=O)C[S+]1CCOCC1.CCCCCCCCc1ccc([I+]c2ccc(CCCCCCCC)cc2)cc1.CCCCCCc1ccc([I+]c2ccc(CCCCCC)cc2)cc1.CCCC[S+](CCCC)CC(=O)C(C)(C)C.CCCC[S+](CCCC)CC(=O)CC.CC[S+](C)CC(C)=O.O=C(C[S+]1CCCC1)c1ccccc1.O=C(C[S+]1CCCCC1)c1ccccc1.O=C(C[S+]1CCOCC1)c1ccccc1
InChIInChI=1S/C28H42I.C24H34I.C14H29OS.C13H17OS.C12H15O2S.C12H15OS.C12H25OS.C11H21OS.C10H19O2S.C10H19OS.C9H17OS.C8H15O2S.C8H15OS.C7H13OS.C6H13OS.C5H11OS/c1-3-5-7-9-11-13-15-25-17-21-27(22-18-25)29-28-23-19-26(20-24-28)16-14-12-10-8-6-4-2;1-3-5-7-9-11-21-13-17-23(18-14-21)25-24-19-15-22(16-20-24)12-10-8-6-4-2;1-6-8-10-16(11-9-7-2)12-13(15)14(3,4)5;14-13(12-7-3-1-4-8-12)11-15-9-5-2-6-10-15;13-12(11-4-2-1-3-5-11)10-15-8-6-14-7-9-15;13-12(10-14-8-4-5-9-14)11-6-2-1-3-7-11;1-4-7-9-14(10-8-5-2)11-12(13)6-3;1-11(2,3)10(12)9-13-7-5-4-6-8-13;1-10(2,3)9(11)8-13-6-4-12-5-7-13;1-10(2,3)9(11)8-12-6-4-5-7-12;1-2-9(10)8-11-6-4-3-5-7-11;1-2-8(9)7-11-5-3-10-4-6-11;1-2-8(9)7-10-5-3-4-6-10;1-7(8)6-9-4-2-3-5-9;1-4-8(3)5-6(2)7;1-5(6)4-7(2)3/h17-24H,3-16H2,1-2H3;13-20H,3-12H2,1-2H3;6-12H2,1-5H3;1,3-4,7-8H,2,5-6,9-11H2;1-5H,6-10H2;1-3,6-7H,4-5,8-10H2;4-11H2,1-3H3;4-9H2,1-3H3;4-8H2,1-3H3;4-8H2,1-3H3;2-8H2,1H3;2-7H2,1H3;2-7H2,1H3;2-6H2,1H3;4-5H2,1-3H3;4H2,1-3H3/q16*+1
InChIKeyAQCKVRJZEMXQPH-UHFFFAOYSA-N
XLogP34.87
TPSA266.67 Ų
H-Bond Donors
H-Bond Acceptors17
Rotatable Bonds76
Heavy Atoms222
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003567.37
LogP ≤ 534.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1017

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'charged_oxygen_or_sulfur_atoms', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}

Analyze bis(4-hexylphenyl)iodanium;bis(4-octylphenyl)iodanium;dibutyl-(3,3-dimethyl-2-oxobutyl)sulfanium;dibutyl(2-oxobutyl)sulfanium;3,3-dimethyl-1-(1,4-oxathian-4-ium-4-yl)butan-2-one;dimethyl(2-oxopropyl)sulfanium;3,3-dimethyl-1-(thian-1-ium-1-yl)butan-2-one;3,3-dimethyl-1-(thiolan-1-ium-1-yl)butan-2-one;ethyl-methyl-(2-oxopropyl)sulfanium;1-(1,4-oxathian-4-ium-4-yl)butan-2-one;2-(1,4-oxathian-4-ium-4-yl)-1-phenylethanone;1-phenyl-2-(thian-1-ium-1-yl)ethanone;1-phenyl-2-(thiolan-1-ium-1-yl)ethanone;1-(thian-1-ium-1-yl)butan-2-one;1-(thiolan-1-ium-1-yl)butan-2-one;1-(thiolan-1-ium-1-yl)propan-2-one with MolForge

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Frequently Asked Questions

What is the IUPAC name of bis(4-hexylphenyl)iodanium;bis(4-octylphenyl)iodanium;dibutyl-(3,3-dimethyl-2-oxobutyl)sulfanium;dibutyl(2-oxobutyl)sulfanium;3,3-dimethyl-1-(1,4-oxathian-4-ium-4-yl)butan-2-one;dimethyl(2-oxopropyl)sulfanium;3,3-dimethyl-1-(thian-1-ium-1-yl)butan-2-one;3,3-dimethyl-1-(thiolan-1-ium-1-yl)butan-2-one;ethyl-methyl-(2-oxopropyl)sulfanium;1-(1,4-oxathian-4-ium-4-yl)butan-2-one;2-(1,4-oxathian-4-ium-4-yl)-1-phenylethanone;1-phenyl-2-(thian-1-ium-1-yl)ethanone;1-phenyl-2-(thiolan-1-ium-1-yl)ethanone;1-(thian-1-ium-1-yl)butan-2-one;1-(thiolan-1-ium-1-yl)butan-2-one;1-(thiolan-1-ium-1-yl)propan-2-one?
The IUPAC name of bis(4-hexylphenyl)iodanium;bis(4-octylphenyl)iodanium;dibutyl-(3,3-dimethyl-2-oxobutyl)sulfanium;dibutyl(2-oxobutyl)sulfanium;3,3-dimethyl-1-(1,4-oxathian-4-ium-4-yl)butan-2-one;dimethyl(2-oxopropyl)sulfanium;3,3-dimethyl-1-(thian-1-ium-1-yl)butan-2-one;3,3-dimethyl-1-(thiolan-1-ium-1-yl)butan-2-one;ethyl-methyl-(2-oxopropyl)sulfanium;1-(1,4-oxathian-4-ium-4-yl)butan-2-one;2-(1,4-oxathian-4-ium-4-yl)-1-phenylethanone;1-phenyl-2-(thian-1-ium-1-yl)ethanone;1-phenyl-2-(thiolan-1-ium-1-yl)ethanone;1-(thian-1-ium-1-yl)butan-2-one;1-(thiolan-1-ium-1-yl)butan-2-one;1-(thiolan-1-ium-1-yl)propan-2-one (CID 157194687) is bis(4-hexylphenyl)iodanium;bis(4-octylphenyl)iodanium;dibutyl-(3,3-dimethyl-2-oxobutyl)sulfanium;dibutyl(2-oxobutyl)sulfanium;3,3-dimethyl-1-(1,4-oxathian-4-ium-4-yl)butan-2-one;dimethyl(2-oxopropyl)sulfanium;3,3-dimethyl-1-(thian-1-ium-1-yl)butan-2-one;3,3-dimethyl-1-(thiolan-1-ium-1-yl)butan-2-one;ethyl-methyl-(2-oxopropyl)sulfanium;1-(1,4-oxathian-4-ium-4-yl)butan-2-one;2-(1,4-oxathian-4-ium-4-yl)-1-phenylethanone;1-phenyl-2-(thian-1-ium-1-yl)ethanone;1-phenyl-2-(thiolan-1-ium-1-yl)ethanone;1-(thian-1-ium-1-yl)butan-2-one;1-(thiolan-1-ium-1-yl)butan-2-one;1-(thiolan-1-ium-1-yl)propan-2-one.
What is the SMILES notation for bis(4-hexylphenyl)iodanium;bis(4-octylphenyl)iodanium;dibutyl-(3,3-dimethyl-2-oxobutyl)sulfanium;dibutyl(2-oxobutyl)sulfanium;3,3-dimethyl-1-(1,4-oxathian-4-ium-4-yl)butan-2-one;dimethyl(2-oxopropyl)sulfanium;3,3-dimethyl-1-(thian-1-ium-1-yl)butan-2-one;3,3-dimethyl-1-(thiolan-1-ium-1-yl)butan-2-one;ethyl-methyl-(2-oxopropyl)sulfanium;1-(1,4-oxathian-4-ium-4-yl)butan-2-one;2-(1,4-oxathian-4-ium-4-yl)-1-phenylethanone;1-phenyl-2-(thian-1-ium-1-yl)ethanone;1-phenyl-2-(thiolan-1-ium-1-yl)ethanone;1-(thian-1-ium-1-yl)butan-2-one;1-(thiolan-1-ium-1-yl)butan-2-one;1-(thiolan-1-ium-1-yl)propan-2-one?
The canonical SMILES for bis(4-hexylphenyl)iodanium;bis(4-octylphenyl)iodanium;dibutyl-(3,3-dimethyl-2-oxobutyl)sulfanium;dibutyl(2-oxobutyl)sulfanium;3,3-dimethyl-1-(1,4-oxathian-4-ium-4-yl)butan-2-one;dimethyl(2-oxopropyl)sulfanium;3,3-dimethyl-1-(thian-1-ium-1-yl)butan-2-one;3,3-dimethyl-1-(thiolan-1-ium-1-yl)butan-2-one;ethyl-methyl-(2-oxopropyl)sulfanium;1-(1,4-oxathian-4-ium-4-yl)butan-2-one;2-(1,4-oxathian-4-ium-4-yl)-1-phenylethanone;1-phenyl-2-(thian-1-ium-1-yl)ethanone;1-phenyl-2-(thiolan-1-ium-1-yl)ethanone;1-(thian-1-ium-1-yl)butan-2-one;1-(thiolan-1-ium-1-yl)butan-2-one;1-(thiolan-1-ium-1-yl)propan-2-one is CC(=O)C[S+](C)C.CC(=O)C[S+]1CCCC1.CC(C)(C)C(=O)C[S+]1CCCC1.CC(C)(C)C(=O)C[S+]1CCCCC1.CC(C)(C)C(=O)C[S+]1CCOCC1.CCC(=O)C[S+]1CCCC1.CCC(=O)C[S+]1CCCCC1.CCC(=O)C[S+]1CCOCC1.CCCCCCCCc1ccc([I+]c2ccc(CCCCCCCC)cc2)cc1.CCCCCCc1ccc([I+]c2ccc(CCCCCC)cc2)cc1.CCCC[S+](CCCC)CC(=O)C(C)(C)C.CCCC[S+](CCCC)CC(=O)CC.CC[S+](C)CC(C)=O.O=C(C[S+]1CCCC1)c1ccccc1.O=C(C[S+]1CCCCC1)c1ccccc1.O=C(C[S+]1CCOCC1)c1ccccc1.
What is the InChIKey of bis(4-hexylphenyl)iodanium;bis(4-octylphenyl)iodanium;dibutyl-(3,3-dimethyl-2-oxobutyl)sulfanium;dibutyl(2-oxobutyl)sulfanium;3,3-dimethyl-1-(1,4-oxathian-4-ium-4-yl)butan-2-one;dimethyl(2-oxopropyl)sulfanium;3,3-dimethyl-1-(thian-1-ium-1-yl)butan-2-one;3,3-dimethyl-1-(thiolan-1-ium-1-yl)butan-2-one;ethyl-methyl-(2-oxopropyl)sulfanium;1-(1,4-oxathian-4-ium-4-yl)butan-2-one;2-(1,4-oxathian-4-ium-4-yl)-1-phenylethanone;1-phenyl-2-(thian-1-ium-1-yl)ethanone;1-phenyl-2-(thiolan-1-ium-1-yl)ethanone;1-(thian-1-ium-1-yl)butan-2-one;1-(thiolan-1-ium-1-yl)butan-2-one;1-(thiolan-1-ium-1-yl)propan-2-one?
The InChIKey is AQCKVRJZEMXQPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H42I.C24H34I.C14H29OS.C13H17OS.C12H15O2S.C12H15OS.C12H25OS.C11H21OS.C10H19O2S.C10H19OS.C9H17OS.C8H15O2S.C8H15OS.C7H13OS.C6H13OS.C5H11OS/c1-3-5-7-9-11-13-15-25-17-21-27(22-18-25)29-28-23-19-26(20-24-28)16-14-12-10-8-6-4-2;1-3-5-7-9-11-21-13-17-23(18-14-21)25-24-19-15-22(16-20-24)12-10-8-6-4-2;1-6-8-10-16(11-9-7-2)12-13(15)14(3,4)5;14-13(12-7-3-1-4-8-12)11-15-9-5-2-6-10-15;13-12(11-4-2-1-3-5-11)10-15-8-6-14-7-9-15;13-12(10-14-8-4-5-9-14)11-6-2-1-3-7-11;1-4-7-9-14(10-8-5-2)11-12(13)6-3;1-11(2,3)10(12)9-13-7-5-4-6-8-13;1-10(2,3)9(11)8-13-6-4-12-5-7-13;1-10(2,3)9(11)8-12-6-4-5-7-12;1-2-9(10)8-11-6-4-3-5-7-11;1-2-8(9)7-11-5-3-10-4-6-11;1-2-8(9)7-10-5-3-4-6-10;1-7(8)6-9-4-2-3-5-9;1-4-8(3)5-6(2)7;1-5(6)4-7(2)3/h17-24H,3-16H2,1-2H3;13-20H,3-12H2,1-2H3;6-12H2,1-5H3;1,3-4,7-8H,2,5-6,9-11H2;1-5H,6-10H2;1-3,6-7H,4-5,8-10H2;4-11H2,1-3H3;4-9H2,1-3H3;4-8H2,1-3H3;4-8H2,1-3H3;2-8H2,1H3;2-7H2,1H3;2-7H2,1H3;2-6H2,1H3;4-5H2,1-3H3;4H2,1-3H3/q16*+1.
What are the key properties of bis(4-hexylphenyl)iodanium;bis(4-octylphenyl)iodanium;dibutyl-(3,3-dimethyl-2-oxobutyl)sulfanium;dibutyl(2-oxobutyl)sulfanium;3,3-dimethyl-1-(1,4-oxathian-4-ium-4-yl)butan-2-one;dimethyl(2-oxopropyl)sulfanium;3,3-dimethyl-1-(thian-1-ium-1-yl)butan-2-one;3,3-dimethyl-1-(thiolan-1-ium-1-yl)butan-2-one;ethyl-methyl-(2-oxopropyl)sulfanium;1-(1,4-oxathian-4-ium-4-yl)butan-2-one;2-(1,4-oxathian-4-ium-4-yl)-1-phenylethanone;1-phenyl-2-(thian-1-ium-1-yl)ethanone;1-phenyl-2-(thiolan-1-ium-1-yl)ethanone;1-(thian-1-ium-1-yl)butan-2-one;1-(thiolan-1-ium-1-yl)butan-2-one;1-(thiolan-1-ium-1-yl)propan-2-one?
bis(4-hexylphenyl)iodanium;bis(4-octylphenyl)iodanium;dibutyl-(3,3-dimethyl-2-oxobutyl)sulfanium;dibutyl(2-oxobutyl)sulfanium;3,3-dimethyl-1-(1,4-oxathian-4-ium-4-yl)butan-2-one;dimethyl(2-oxopropyl)sulfanium;3,3-dimethyl-1-(thian-1-ium-1-yl)butan-2-one;3,3-dimethyl-1-(thiolan-1-ium-1-yl)butan-2-one;ethyl-methyl-(2-oxopropyl)sulfanium;1-(1,4-oxathian-4-ium-4-yl)butan-2-one;2-(1,4-oxathian-4-ium-4-yl)-1-phenylethanone;1-phenyl-2-(thian-1-ium-1-yl)ethanone;1-phenyl-2-(thiolan-1-ium-1-yl)ethanone;1-(thian-1-ium-1-yl)butan-2-one;1-(thiolan-1-ium-1-yl)butan-2-one;1-(thiolan-1-ium-1-yl)propan-2-one has a molecular weight of 3567.37 g/mol, XLogP of 34.87, 76 rotatable bonds, 0 hydrogen bond donors, and 17 hydrogen bond acceptors.
Where does this data come from?
All data for bis(4-hexylphenyl)iodanium;bis(4-octylphenyl)iodanium;dibutyl-(3,3-dimethyl-2-oxobutyl)sulfanium;dibutyl(2-oxobutyl)sulfanium;3,3-dimethyl-1-(1,4-oxathian-4-ium-4-yl)butan-2-one;dimethyl(2-oxopropyl)sulfanium;3,3-dimethyl-1-(thian-1-ium-1-yl)butan-2-one;3,3-dimethyl-1-(thiolan-1-ium-1-yl)butan-2-one;ethyl-methyl-(2-oxopropyl)sulfanium;1-(1,4-oxathian-4-ium-4-yl)butan-2-one;2-(1,4-oxathian-4-ium-4-yl)-1-phenylethanone;1-phenyl-2-(thian-1-ium-1-yl)ethanone;1-phenyl-2-(thiolan-1-ium-1-yl)ethanone;1-(thian-1-ium-1-yl)butan-2-one;1-(thiolan-1-ium-1-yl)butan-2-one;1-(thiolan-1-ium-1-yl)propan-2-one is sourced from PubChem (CID 157194687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).