1-(4-cyclohexylphenyl)-2-methyl-2-(thiolan-1-ium-1-yl)propan-1-one;1-ethyl-4-[2-(1-methylcyclopentyl)-1-pentan-3-yloxyethoxy]benzene;bis(4-ethylphenol);8-[1-(4-ethylphenoxy)-3,3-dimethylbutoxy]tricyclo[5.2.1.02,6]decane;2-[2-(4-ethylphenoxy)-2-oxoethoxy]-1,1-difluoropropane-1-sulfonate;4-(4-ethylphenoxy)-2,3,5,6-tetrafluorobenzenesulfonate;10-phenylphenoxathiin-10-ium

C126H156F6O18S4 — CID 159099779

IUPAC1-(4-cyclohexylphenyl)-2-methyl-2-(thiolan-1-ium-1-yl)propan-1-one;1-ethyl-4-[2-(1-methylcyclopentyl)-1-pentan-3-yloxyethoxy]benzene;bis(4-ethylphenol);8-[1-(4-ethylphenoxy)-3,3-dimethylbutoxy]tricyclo[5.2.1.02,6]decane;2-[2-(4-ethylphenoxy)-2-oxoethoxy]-1,1-difluoropropane-1-sulfonate;4-(4-ethylphenoxy)-2,3,5,6-tetrafluorobenzenesulfonate;10-phenylphenoxathiin-10-ium
SMILESCC(C)(C(=O)c1ccc(C2CCCCC2)cc1)[S+]1CCCC1.CCc1ccc(O)cc1.CCc1ccc(O)cc1.CCc1ccc(OC(=O)COC(C)C(F)(F)S(=O)(=O)[O-])cc1.CCc1ccc(OC(CC(C)(C)C)OC2CC3CC2C2CCCC32)cc1.CCc1ccc(OC(CC2(C)CCCC2)OC(CC)CC)cc1.CCc1ccc(Oc2c(F)c(F)c(S(=O)(=O)[O-])c(F)c2F)cc1.c1ccc([S+]2c3ccccc3Oc3ccccc32)cc1
InChIInChI=1S/C24H36O2.C21H34O2.C20H29OS.C18H13OS.C14H10F4O4S.C13H16F2O6S.2C8H10O/c1-5-16-9-11-18(12-10-16)25-23(15-24(2,3)4)26-22-14-17-13-21(22)20-8-6-7-19(17)20;1-5-17-10-12-19(13-11-17)23-20(22-18(6-2)7-3)16-21(4)14-8-9-15-21;1-20(2,22-14-6-7-15-22)19(21)18-12-10-17(11-13-18)16-8-4-3-5-9-16;1-2-8-14(9-3-1)20-17-12-6-4-10-15(17)19-16-11-5-7-13-18(16)20;1-2-7-3-5-8(6-4-7)22-13-9(15)11(17)14(23(19,20)21)12(18)10(13)16;1-3-10-4-6-11(7-5-10)21-12(16)8-20-9(2)13(14,15)22(17,18)19;2*1-2-7-3-5-8(9)6-4-7/h9-12,17,19-23H,5-8,13-15H2,1-4H3;10-13,18,20H,5-9,14-16H2,1-4H3;10-13,16H,3-9,14-15H2,1-2H3;1-13H;3-6H,2H2,1H3,(H,19,20,21);4-7,9H,3,8H2,1-2H3,(H,17,18,19);2*3-6,9H,2H2,1H3/q;;2*+1;;;;/p-2
InChIKeyKDDCOSWELKYLAJ-UHFFFAOYSA-L
MW2200.87 g/mol
LogP31.46
Rot. Bonds33

About 1-(4-cyclohexylphenyl)-2-methyl-2-(thiolan-1-ium-1-yl)propan-1-one;1-ethyl-4-[2-(1-methylcyclopentyl)-1-pentan-3-yloxyethoxy]benzene;bis(4-ethylphenol);8-[1-(4-ethylphenoxy)-3,3-dimethylbutoxy]tricyclo[5.2.1.02,6]decane;2-[2-(4-ethylphenoxy)-2-oxoethoxy]-1,1-difluoropropane-1-sulfonate;4-(4-ethylphenoxy)-2,3,5,6-tetrafluorobenzenesulfonate;10-phenylphenoxathiin-10-ium

1-(4-cyclohexylphenyl)-2-methyl-2-(thiolan-1-ium-1-yl)propan-1-one;1-ethyl-4-[2-(1-methylcyclopentyl)-1-pentan-3-yloxyethoxy]benzene;bis(4-ethylphenol);8-[1-(4-ethylphenoxy)-3,3-dimethylbutoxy]tricyclo[5.2.1.02,6]decane;2-[2-(4-ethylphenoxy)-2-oxoethoxy]-1,1-difluoropropane-1-sulfonate;4-(4-ethylphenoxy)-2,3,5,6-tetrafluorobenzenesulfonate;10-phenylphenoxathiin-10-ium (PubChem CID 159099779) has the molecular formula C126H156F6O18S4 and a molecular weight of 2200.87 g/mol. Its IUPAC name is 1-(4-cyclohexylphenyl)-2-methyl-2-(thiolan-1-ium-1-yl)propan-1-one;1-ethyl-4-[2-(1-methylcyclopentyl)-1-pentan-3-yloxyethoxy]benzene;bis(4-ethylphenol);8-[1-(4-ethylphenoxy)-3,3-dimethylbutoxy]tricyclo[5.2.1.02,6]decane;2-[2-(4-ethylphenoxy)-2-oxoethoxy]-1,1-difluoropropane-1-sulfonate;4-(4-ethylphenoxy)-2,3,5,6-tetrafluorobenzenesulfonate;10-phenylphenoxathiin-10-ium.

Molecular Properties

Compound Name1-(4-cyclohexylphenyl)-2-methyl-2-(thiolan-1-ium-1-yl)propan-1-one;1-ethyl-4-[2-(1-methylcyclopentyl)-1-pentan-3-yloxyethoxy]benzene;bis(4-ethylphenol);8-[1-(4-ethylphenoxy)-3,3-dimethylbutoxy]tricyclo[5.2.1.02,6]decane;2-[2-(4-ethylphenoxy)-2-oxoethoxy]-1,1-difluoropropane-1-sulfonate;4-(4-ethylphenoxy)-2,3,5,6-tetrafluorobenzenesulfonate;10-phenylphenoxathiin-10-ium
PubChem CID159099779
Molecular FormulaC126H156F6O18S4
Molecular Weight2200.87 g/mol
Exact Mass2199.01
IUPAC Name1-(4-cyclohexylphenyl)-2-methyl-2-(thiolan-1-ium-1-yl)propan-1-one;1-ethyl-4-[2-(1-methylcyclopentyl)-1-pentan-3-yloxyethoxy]benzene;bis(4-ethylphenol);8-[1-(4-ethylphenoxy)-3,3-dimethylbutoxy]tricyclo[5.2.1.02,6]decane;2-[2-(4-ethylphenoxy)-2-oxoethoxy]-1,1-difluoropropane-1-sulfonate;4-(4-ethylphenoxy)-2,3,5,6-tetrafluorobenzenesulfonate;10-phenylphenoxathiin-10-ium
SMILESCC(C)(C(=O)c1ccc(C2CCCCC2)cc1)[S+]1CCCC1.CCc1ccc(O)cc1.CCc1ccc(O)cc1.CCc1ccc(OC(=O)COC(C)C(F)(F)S(=O)(=O)[O-])cc1.CCc1ccc(OC(CC(C)(C)C)OC2CC3CC2C2CCCC32)cc1.CCc1ccc(OC(CC2(C)CCCC2)OC(CC)CC)cc1.CCc1ccc(Oc2c(F)c(F)c(S(=O)(=O)[O-])c(F)c2F)cc1.c1ccc([S+]2c3ccccc3Oc3ccccc32)cc1
InChIInChI=1S/C24H36O2.C21H34O2.C20H29OS.C18H13OS.C14H10F4O4S.C13H16F2O6S.2C8H10O/c1-5-16-9-11-18(12-10-16)25-23(15-24(2,3)4)26-22-14-17-13-21(22)20-8-6-7-19(17)20;1-5-17-10-12-19(13-11-17)23-20(22-18(6-2)7-3)16-21(4)14-8-9-15-21;1-20(2,22-14-6-7-15-22)19(21)18-12-10-17(11-13-18)16-8-4-3-5-9-16;1-2-8-14(9-3-1)20-17-12-6-4-10-15(17)19-16-11-5-7-13-18(16)20;1-2-7-3-5-8(6-4-7)22-13-9(15)11(17)14(23(19,20)21)12(18)10(13)16;1-3-10-4-6-11(7-5-10)21-12(16)8-20-9(2)13(14,15)22(17,18)19;2*1-2-7-3-5-8(9)6-4-7/h9-12,17,19-23H,5-8,13-15H2,1-4H3;10-13,18,20H,5-9,14-16H2,1-4H3;10-13,16H,3-9,14-15H2,1-2H3;1-13H;3-6H,2H2,1H3,(H,19,20,21);4-7,9H,3,8H2,1-2H3,(H,17,18,19);2*3-6,9H,2H2,1H3/q;;2*+1;;;;/p-2
InChIKeyKDDCOSWELKYLAJ-UHFFFAOYSA-L
XLogP31.46
TPSA262.84 Ų
H-Bond Donors2
H-Bond Acceptors18
Rotatable Bonds33
Heavy Atoms154
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002200.87
LogP ≤ 531.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1018

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'charged_oxygen_or_sulfur_atoms', 'substructure': 'N/A'}, {'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'phenol_ester', 'substructure': 'N/A'}, {'alert_name': 'Sulfonic_acid_2', 'substructure': 'N/A'}

Analyze 1-(4-cyclohexylphenyl)-2-methyl-2-(thiolan-1-ium-1-yl)propan-1-one;1-ethyl-4-[2-(1-methylcyclopentyl)-1-pentan-3-yloxyethoxy]benzene;bis(4-ethylphenol);8-[1-(4-ethylphenoxy)-3,3-dimethylbutoxy]tricyclo[5.2.1.02,6]decane;2-[2-(4-ethylphenoxy)-2-oxoethoxy]-1,1-difluoropropane-1-sulfonate;4-(4-ethylphenoxy)-2,3,5,6-tetrafluorobenzenesulfonate;10-phenylphenoxathiin-10-ium with MolForge

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Related Compounds

1-Butan-2-yl-4-[1-[2-(4-cyclohexylphenoxy)ethoxy]ethoxy]benzene;6-butan-2-ylnaphthalen-2-ol;bis(4-butan-2-ylphenol);3-[4-(2,2-dimethylbutanoyloxycarbonyl)phenoxy]sulfonyl-1,1,2,2,3,3-hexafluoropropane-1-sulfonate;3-[4-(2,2-dimethylbutanoyloxysulfonyl)phenoxy]sulfonyl-1,1,2,2,3,3-hexafluoropropane-1-sulfonate;formaldehyde;[2-oxo-2-[(5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl)oxy]ethyl] 2,2-dimethylbutanoate;triphenylsulfanium
CID 158116692
Bis(4-butan-2-ylphenol);4-[2-(4-butan-2-ylphenoxy)acetyl]oxybenzenesulfonate;2-(4-butan-2-ylphenoxy)carbonylbenzenesulfonate;3-(4-butan-2-ylphenoxy)-1,1-difluoro-3-oxopropane-1-sulfonate;2-[1-(4-butan-2-ylphenoxy)ethoxymethyl]bicyclo[2.2.1]heptane;(1-ethylcyclopentyl) 2-(4-butan-2-ylphenoxy)acetate;2-methyl-1-(4-methylphenyl)-2-(thiolan-1-ium-1-yl)propan-1-one;triphenylsulfanium
CID 159076878
4-Butan-2-ylphenol;8-[1-(4-butan-2-ylphenoxy)-2-methylpropoxy]tricyclo[5.2.1.02,6]decane;tert-butyl 4-butan-2-ylbenzoate;bis(2-(2,2-dimethylbutanoyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate);bis(1,2-dimethyl-1,2-dihydroacenaphthylene);(4-hydroxyphenyl) 2,2-dimethylbutanoate;bis(10-phenylphenoxathiin-10-ium)
CID 159189117
(1-benzylcyclopentyl) 2,2-dimethylbutanoate;2-(4-butan-2-ylphenyl)-1,1,1-trifluoropropan-2-ol;(3,5-dihydroxy-1-adamantyl) 2,2-dimethylbutanoate;2-[2-(2,2-dimethylbutanoyloxy)acetyl]oxy-1,1,3,3,3-pentafluoropropane-1-sulfonate;4-(2,2-dimethylbutanoyloxy)-1,1,2,2-tetrafluorobutane-1-sulfonate;1,2-dimethyl-2,3-dihydro-1H-indene;(4-hydroxyphenyl) 2,2-dimethylbutanoate;[4-[2-methyl-1-(8-tricyclo[5.2.1.02,6]decanyloxy)propoxy]phenyl] 2,2-dimethylbutanoate;10-phenylphenoxathiin-10-ium;triphenylsulfanium
CID 159531362
4-Butan-2-yl-2-fluoro-1-(2-methylbutan-2-yloxy)benzene;3-butan-2-ylphenol;4-butan-2-ylphenol;2-(4-butan-2-ylphenyl)propan-2-ol;2-[9-(2,2-dimethylbutanoyloxy)-4-oxotricyclo[4.2.1.03,7]nonane-2-carbonyl]oxy-3,3,3-trifluoropropane-1-sulfonate;3-ethyl-3-methyloxolan-2-one;(1-methylcyclopentyl) 2,2-dimethylbutanoate;10-phenylphenoxathiin-10-ium
CID 160501372
1-Butan-2-yl-4-(1-cyclohexyloxyethoxy)benzene;4-butan-2-ylphenol;2-(4-butan-2-ylphenoxy)oxane;1-(4-butan-2-ylphenyl)-2-methyl-2-(thiolan-1-ium-1-yl)propan-1-one;1-(4-butoxynaphthalen-1-yl)thiolan-1-ium;2-[2-(2,2-dimethylbutanoyloxy)acetyl]oxy-3,3,3-trifluoropropane-1-sulfonate;(1-ethylcyclopentyl) 2,2-dimethylbutanoate;methane;1,2,3,4,5-pentafluoro-6-methylbenzene
CID 160769795
4-Butan-2-ylphenol;2-(4-butan-2-ylphenoxy)carbonylbenzenesulfonate;1-[(4-butan-2-ylphenoxy)-methoxymethyl]adamantane;4-[1-(4-butan-2-ylphenoxy)-2-methylpropoxy]tetracyclo[6.2.1.13,6.02,7]dodecane;2-(2,2-dimethylbutanoyloxy)-1,1-difluoropropane-1-sulfonate;1,2-dimethyl-1,2-dihydroacenaphthylene;(4-hydroxyphenyl) 2,2-dimethylbutanoate;bis(triphenylsulfanium)
CID 161061211
(1-benzylcyclopentyl) 2,2-dimethylbutanoate;(3,5-dihydroxy-1-adamantyl) 2,2-dimethylbutanoate;2-[2-(2,2-dimethylbutanoyloxy)acetyl]oxy-1,1,3,3,3-pentafluoropropane-1-sulfonate;4-(2,2-dimethylbutanoyloxy)-1,1,2,2-tetrafluorobutane-1-sulfonate;1,2-dimethyl-2,3-dihydro-1H-indene;(4-hydroxyphenyl) 2,2-dimethylbutanoate;[4-[2-methyl-1-(8-tricyclo[5.2.1.02,6]decanyloxy)propoxy]phenyl] 2,2-dimethylbutanoate;10-phenylphenoxathiin-10-ium;1,1,1-trifluoro-2-[4-(2-methylbutan-2-yl)phenyl]propan-2-ol;triphenylsulfanium
CID 161457573
1-Butan-2-yl-4-(1-cyclohexyloxy-3,3-dimethylbutoxy)benzene;4-butan-2-ylphenol;8-[1-(4-butan-2-ylphenoxy)-2-methylpropoxy]tricyclo[5.2.1.02,6]decane;(4-butan-2-ylphenyl) adamantane-2-carboxylate;4-butan-2-yl-2,3,5,6-tetrafluorobenzenesulfonate;1-(4-cyclohexylphenyl)-2-methyl-2-(thiolan-1-ium-1-yl)propan-1-one
CID 159362749
2-(1-Adamantyl)butan-2-yl 2,2-dimethylbutanoate;bis(4-butan-2-ylphenol);4-(4-butan-2-ylphenoxy)benzenesulfonate;4-(4-butan-2-ylphenoxy)-2,3,5,6-tetrafluorobenzenesulfonate;4-[(4-butan-2-ylphenyl)methyl]-2,3,5,6-tetrafluorobenzenesulfonate;[1-(2,2-dimethylpropoxy)-3,3-dimethylbutyl] 2,2-dimethylbutanoate;1-(4-methoxyphenyl)-3,3-dimethyl-2-(thiolan-1-ium-1-yl)butan-1-one;(5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2,2-dimethylbutanoate;bis(triphenylsulfanium)
CID 160825211
2-Butan-2-yl-6-[1-(naphthalen-1-ylmethoxy)-2-phenoxyethoxy]naphthalene;4-butan-2-ylphenol;2-(4-butan-2-ylphenoxy)carbonylbenzenesulfonate;[2-(4-butan-2-ylphenoxy)-2-ethoxyethyl] adamantane-1-carboxylate;8-[1-(4-butan-2-ylphenoxy)-2-methyl-2-phenoxypropoxy]tricyclo[5.2.1.02,6]decane;1,2-dimethyl-1,2-dihydroacenaphthylene;2,4-dimethyl-2-(thiolan-1-ium-1-yl)pentan-3-one;(6-hydroxynaphthalen-2-yl) 2,2-dimethylbutanoate;(4-hydroxyphenyl) 2,2-dimethylbutanoate
CID 161205872
1-Butan-2-yl-4-[(1-methylcyclohexyl)-propan-2-yloxymethoxy]benzene;4-butan-2-ylphenol;8-[1-(4-butan-2-ylphenoxy)-2-cyclohexylpropoxy]tricyclo[5.2.1.02,6]decane;1-[(4-butan-2-ylphenoxy)-propan-2-yloxymethyl]adamantane;4-butan-2-yl-2,3,5,6-tetrafluorobenzenesulfonate;1-(4-cyclohexylphenyl)-2-methyl-2-(thiolan-1-ium-1-yl)propan-1-one
CID 161717588

Frequently Asked Questions

What is the IUPAC name of 1-(4-cyclohexylphenyl)-2-methyl-2-(thiolan-1-ium-1-yl)propan-1-one;1-ethyl-4-[2-(1-methylcyclopentyl)-1-pentan-3-yloxyethoxy]benzene;bis(4-ethylphenol);8-[1-(4-ethylphenoxy)-3,3-dimethylbutoxy]tricyclo[5.2.1.02,6]decane;2-[2-(4-ethylphenoxy)-2-oxoethoxy]-1,1-difluoropropane-1-sulfonate;4-(4-ethylphenoxy)-2,3,5,6-tetrafluorobenzenesulfonate;10-phenylphenoxathiin-10-ium?
The IUPAC name of 1-(4-cyclohexylphenyl)-2-methyl-2-(thiolan-1-ium-1-yl)propan-1-one;1-ethyl-4-[2-(1-methylcyclopentyl)-1-pentan-3-yloxyethoxy]benzene;bis(4-ethylphenol);8-[1-(4-ethylphenoxy)-3,3-dimethylbutoxy]tricyclo[5.2.1.02,6]decane;2-[2-(4-ethylphenoxy)-2-oxoethoxy]-1,1-difluoropropane-1-sulfonate;4-(4-ethylphenoxy)-2,3,5,6-tetrafluorobenzenesulfonate;10-phenylphenoxathiin-10-ium (CID 159099779) is 1-(4-cyclohexylphenyl)-2-methyl-2-(thiolan-1-ium-1-yl)propan-1-one;1-ethyl-4-[2-(1-methylcyclopentyl)-1-pentan-3-yloxyethoxy]benzene;bis(4-ethylphenol);8-[1-(4-ethylphenoxy)-3,3-dimethylbutoxy]tricyclo[5.2.1.02,6]decane;2-[2-(4-ethylphenoxy)-2-oxoethoxy]-1,1-difluoropropane-1-sulfonate;4-(4-ethylphenoxy)-2,3,5,6-tetrafluorobenzenesulfonate;10-phenylphenoxathiin-10-ium.
What is the SMILES notation for 1-(4-cyclohexylphenyl)-2-methyl-2-(thiolan-1-ium-1-yl)propan-1-one;1-ethyl-4-[2-(1-methylcyclopentyl)-1-pentan-3-yloxyethoxy]benzene;bis(4-ethylphenol);8-[1-(4-ethylphenoxy)-3,3-dimethylbutoxy]tricyclo[5.2.1.02,6]decane;2-[2-(4-ethylphenoxy)-2-oxoethoxy]-1,1-difluoropropane-1-sulfonate;4-(4-ethylphenoxy)-2,3,5,6-tetrafluorobenzenesulfonate;10-phenylphenoxathiin-10-ium?
The canonical SMILES for 1-(4-cyclohexylphenyl)-2-methyl-2-(thiolan-1-ium-1-yl)propan-1-one;1-ethyl-4-[2-(1-methylcyclopentyl)-1-pentan-3-yloxyethoxy]benzene;bis(4-ethylphenol);8-[1-(4-ethylphenoxy)-3,3-dimethylbutoxy]tricyclo[5.2.1.02,6]decane;2-[2-(4-ethylphenoxy)-2-oxoethoxy]-1,1-difluoropropane-1-sulfonate;4-(4-ethylphenoxy)-2,3,5,6-tetrafluorobenzenesulfonate;10-phenylphenoxathiin-10-ium is CC(C)(C(=O)c1ccc(C2CCCCC2)cc1)[S+]1CCCC1.CCc1ccc(O)cc1.CCc1ccc(O)cc1.CCc1ccc(OC(=O)COC(C)C(F)(F)S(=O)(=O)[O-])cc1.CCc1ccc(OC(CC(C)(C)C)OC2CC3CC2C2CCCC32)cc1.CCc1ccc(OC(CC2(C)CCCC2)OC(CC)CC)cc1.CCc1ccc(Oc2c(F)c(F)c(S(=O)(=O)[O-])c(F)c2F)cc1.c1ccc([S+]2c3ccccc3Oc3ccccc32)cc1.
What is the InChIKey of 1-(4-cyclohexylphenyl)-2-methyl-2-(thiolan-1-ium-1-yl)propan-1-one;1-ethyl-4-[2-(1-methylcyclopentyl)-1-pentan-3-yloxyethoxy]benzene;bis(4-ethylphenol);8-[1-(4-ethylphenoxy)-3,3-dimethylbutoxy]tricyclo[5.2.1.02,6]decane;2-[2-(4-ethylphenoxy)-2-oxoethoxy]-1,1-difluoropropane-1-sulfonate;4-(4-ethylphenoxy)-2,3,5,6-tetrafluorobenzenesulfonate;10-phenylphenoxathiin-10-ium?
The InChIKey is KDDCOSWELKYLAJ-UHFFFAOYSA-L. The full InChI is InChI=1S/C24H36O2.C21H34O2.C20H29OS.C18H13OS.C14H10F4O4S.C13H16F2O6S.2C8H10O/c1-5-16-9-11-18(12-10-16)25-23(15-24(2,3)4)26-22-14-17-13-21(22)20-8-6-7-19(17)20;1-5-17-10-12-19(13-11-17)23-20(22-18(6-2)7-3)16-21(4)14-8-9-15-21;1-20(2,22-14-6-7-15-22)19(21)18-12-10-17(11-13-18)16-8-4-3-5-9-16;1-2-8-14(9-3-1)20-17-12-6-4-10-15(17)19-16-11-5-7-13-18(16)20;1-2-7-3-5-8(6-4-7)22-13-9(15)11(17)14(23(19,20)21)12(18)10(13)16;1-3-10-4-6-11(7-5-10)21-12(16)8-20-9(2)13(14,15)22(17,18)19;2*1-2-7-3-5-8(9)6-4-7/h9-12,17,19-23H,5-8,13-15H2,1-4H3;10-13,18,20H,5-9,14-16H2,1-4H3;10-13,16H,3-9,14-15H2,1-2H3;1-13H;3-6H,2H2,1H3,(H,19,20,21);4-7,9H,3,8H2,1-2H3,(H,17,18,19);2*3-6,9H,2H2,1H3/q;;2*+1;;;;/p-2.
What are the key properties of 1-(4-cyclohexylphenyl)-2-methyl-2-(thiolan-1-ium-1-yl)propan-1-one;1-ethyl-4-[2-(1-methylcyclopentyl)-1-pentan-3-yloxyethoxy]benzene;bis(4-ethylphenol);8-[1-(4-ethylphenoxy)-3,3-dimethylbutoxy]tricyclo[5.2.1.02,6]decane;2-[2-(4-ethylphenoxy)-2-oxoethoxy]-1,1-difluoropropane-1-sulfonate;4-(4-ethylphenoxy)-2,3,5,6-tetrafluorobenzenesulfonate;10-phenylphenoxathiin-10-ium?
1-(4-cyclohexylphenyl)-2-methyl-2-(thiolan-1-ium-1-yl)propan-1-one;1-ethyl-4-[2-(1-methylcyclopentyl)-1-pentan-3-yloxyethoxy]benzene;bis(4-ethylphenol);8-[1-(4-ethylphenoxy)-3,3-dimethylbutoxy]tricyclo[5.2.1.02,6]decane;2-[2-(4-ethylphenoxy)-2-oxoethoxy]-1,1-difluoropropane-1-sulfonate;4-(4-ethylphenoxy)-2,3,5,6-tetrafluorobenzenesulfonate;10-phenylphenoxathiin-10-ium has a molecular weight of 2200.87 g/mol, XLogP of 31.46, 33 rotatable bonds, 2 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-cyclohexylphenyl)-2-methyl-2-(thiolan-1-ium-1-yl)propan-1-one;1-ethyl-4-[2-(1-methylcyclopentyl)-1-pentan-3-yloxyethoxy]benzene;bis(4-ethylphenol);8-[1-(4-ethylphenoxy)-3,3-dimethylbutoxy]tricyclo[5.2.1.02,6]decane;2-[2-(4-ethylphenoxy)-2-oxoethoxy]-1,1-difluoropropane-1-sulfonate;4-(4-ethylphenoxy)-2,3,5,6-tetrafluorobenzenesulfonate;10-phenylphenoxathiin-10-ium is sourced from PubChem (CID 159099779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).