bis(4-butan-2-ylphenol);3-[4-[4-(4-butan-2-ylphenoxy)-4-oxobutyl]sulfanylphenoxy]sulfonyl-1,1,2,2,3,3-hexafluoropropane-1-sulfonate;3-[4-[2-(4-butan-2-ylphenoxy)sulfonylethoxycarbonyl]phenoxy]sulfonyl-1,1,2,2,3,3-hexafluoropropane-1-sulfonate;(4-butan-2-ylphenyl) tert-butyl carbonate;(6-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2,2-dimethylbutanoate;[2-[(6-cyano-5-oxo-2-tricyclo[4.2.1.03,7]nonanyl)oxy]-2-oxoethyl] 2,2-dimethylbutanoate;3-cyclohexylpentan-3-yl 2,2-dimethylbutanoate;1-(2-ethylhexoxy)-2,4,6-trimethylpyridin-1-ium;4-fluoro-1-phenylmethoxypyridin-1-ium

C158H207F13N4O37S6 — CID 160702408

IUPACbis(4-butan-2-ylphenol);3-[4-[4-(4-butan-2-ylphenoxy)-4-oxobutyl]sulfanylphenoxy]sulfonyl-1,1,2,2,3,3-hexafluoropropane-1-sulfonate;3-[4-[2-(4-butan-2-ylphenoxy)sulfonylethoxycarbonyl]phenoxy]sulfonyl-1,1,2,2,3,3-hexafluoropropane-1-sulfonate;(4-butan-2-ylphenyl) tert-butyl carbonate;(6-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2,2-dimethylbutanoate;[2-[(6-cyano-5-oxo-2-tricyclo[4.2.1.03,7]nonanyl)oxy]-2-oxoethyl] 2,2-dimethylbutanoate;3-cyclohexylpentan-3-yl 2,2-dimethylbutanoate;1-(2-ethylhexoxy)-2,4,6-trimethylpyridin-1-ium;4-fluoro-1-phenylmethoxypyridin-1-ium
SMILESCCC(C)(C)C(=O)OC(CC)(CC)C1CCCCC1.CCC(C)(C)C(=O)OC1C2CC3C1OC(=O)C3(C#N)C2.CCC(C)(C)C(=O)OCC(=O)OC1C2CC3C1CC(=O)C3(C#N)C2.CCC(C)c1ccc(O)cc1.CCC(C)c1ccc(O)cc1.CCC(C)c1ccc(OC(=O)CCCSc2ccc(OS(=O)(=O)C(F)(F)C(F)(F)C(F)(F)S(=O)(=O)[O-])cc2)cc1.CCC(C)c1ccc(OC(=O)OC(C)(C)C)cc1.CCC(C)c1ccc(OS(=O)(=O)CCOC(=O)c2ccc(OS(=O)(=O)C(F)(F)C(F)(F)C(F)(F)S(=O)(=O)[O-])cc2)cc1.CCCCC(CC)CO[n+]1c(C)cc(C)cc1C.Fc1cc[n+](OCc2ccccc2)cc1
InChIInChI=1S/C23H24F6O8S3.C22H22F6O11S3.C18H23NO5.C17H32O2.C16H28NO.C15H19NO4.C15H22O3.C12H11FNO.2C10H14O/c1-3-15(2)16-6-8-17(9-7-16)36-20(30)5-4-14-38-19-12-10-18(11-13-19)37-40(34,35)23(28,29)21(24,25)22(26,27)39(31,32)33;1-3-14(2)15-4-8-17(9-5-15)38-40(30,31)13-12-37-19(29)16-6-10-18(11-7-16)39-42(35,36)22(27,28)20(23,24)21(25,26)41(32,33)34;1-4-17(2,3)16(22)23-8-14(21)24-15-10-5-12-11(15)6-13(20)18(12,7-10)9-19;1-6-16(4,5)15(18)19-17(7-2,8-3)14-12-10-9-11-13-14;1-6-8-9-16(7-2)12-18-17-14(4)10-13(3)11-15(17)5;1-4-14(2,3)12(17)19-10-8-5-9-11(10)20-13(18)15(9,6-8)7-16;1-6-11(2)12-7-9-13(10-8-12)17-14(16)18-15(3,4)5;13-12-6-8-14(9-7-12)15-10-11-4-2-1-3-5-11;2*1-3-8(2)9-4-6-10(11)7-5-9/h6-13,15H,3-5,14H2,1-2H3,(H,31,32,33);4-11,14H,3,12-13H2,1-2H3,(H,32,33,34);10-12,15H,4-8H2,1-3H3;14H,6-13H2,1-5H3;10-11,16H,6-9,12H2,1-5H3;8-11H,4-6H2,1-3H3;7-11H,6H2,1-5H3;1-9H,10H2;2*4-8,11H,3H2,1-2H3/q;;;;+1;;;+1;;/p-2
InChIKeyRQUFSHOSKQPKOM-UHFFFAOYSA-L
MW3193.76 g/mol
LogP34.14
Rot. Bonds59

About bis(4-butan-2-ylphenol);3-[4-[4-(4-butan-2-ylphenoxy)-4-oxobutyl]sulfanylphenoxy]sulfonyl-1,1,2,2,3,3-hexafluoropropane-1-sulfonate;3-[4-[2-(4-butan-2-ylphenoxy)sulfonylethoxycarbonyl]phenoxy]sulfonyl-1,1,2,2,3,3-hexafluoropropane-1-sulfonate;(4-butan-2-ylphenyl) tert-butyl carbonate;(6-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2,2-dimethylbutanoate;[2-[(6-cyano-5-oxo-2-tricyclo[4.2.1.03,7]nonanyl)oxy]-2-oxoethyl] 2,2-dimethylbutanoate;3-cyclohexylpentan-3-yl 2,2-dimethylbutanoate;1-(2-ethylhexoxy)-2,4,6-trimethylpyridin-1-ium;4-fluoro-1-phenylmethoxypyridin-1-ium

bis(4-butan-2-ylphenol);3-[4-[4-(4-butan-2-ylphenoxy)-4-oxobutyl]sulfanylphenoxy]sulfonyl-1,1,2,2,3,3-hexafluoropropane-1-sulfonate;3-[4-[2-(4-butan-2-ylphenoxy)sulfonylethoxycarbonyl]phenoxy]sulfonyl-1,1,2,2,3,3-hexafluoropropane-1-sulfonate;(4-butan-2-ylphenyl) tert-butyl carbonate;(6-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2,2-dimethylbutanoate;[2-[(6-cyano-5-oxo-2-tricyclo[4.2.1.03,7]nonanyl)oxy]-2-oxoethyl] 2,2-dimethylbutanoate;3-cyclohexylpentan-3-yl 2,2-dimethylbutanoate;1-(2-ethylhexoxy)-2,4,6-trimethylpyridin-1-ium;4-fluoro-1-phenylmethoxypyridin-1-ium (PubChem CID 160702408) has the molecular formula C158H207F13N4O37S6 and a molecular weight of 3193.76 g/mol. Its IUPAC name is bis(4-butan-2-ylphenol);3-[4-[4-(4-butan-2-ylphenoxy)-4-oxobutyl]sulfanylphenoxy]sulfonyl-1,1,2,2,3,3-hexafluoropropane-1-sulfonate;3-[4-[2-(4-butan-2-ylphenoxy)sulfonylethoxycarbonyl]phenoxy]sulfonyl-1,1,2,2,3,3-hexafluoropropane-1-sulfonate;(4-butan-2-ylphenyl) tert-butyl carbonate;(6-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2,2-dimethylbutanoate;[2-[(6-cyano-5-oxo-2-tricyclo[4.2.1.03,7]nonanyl)oxy]-2-oxoethyl] 2,2-dimethylbutanoate;3-cyclohexylpentan-3-yl 2,2-dimethylbutanoate;1-(2-ethylhexoxy)-2,4,6-trimethylpyridin-1-ium;4-fluoro-1-phenylmethoxypyridin-1-ium.

Molecular Properties

Compound Namebis(4-butan-2-ylphenol);3-[4-[4-(4-butan-2-ylphenoxy)-4-oxobutyl]sulfanylphenoxy]sulfonyl-1,1,2,2,3,3-hexafluoropropane-1-sulfonate;3-[4-[2-(4-butan-2-ylphenoxy)sulfonylethoxycarbonyl]phenoxy]sulfonyl-1,1,2,2,3,3-hexafluoropropane-1-sulfonate;(4-butan-2-ylphenyl) tert-butyl carbonate;(6-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2,2-dimethylbutanoate;[2-[(6-cyano-5-oxo-2-tricyclo[4.2.1.03,7]nonanyl)oxy]-2-oxoethyl] 2,2-dimethylbutanoate;3-cyclohexylpentan-3-yl 2,2-dimethylbutanoate;1-(2-ethylhexoxy)-2,4,6-trimethylpyridin-1-ium;4-fluoro-1-phenylmethoxypyridin-1-ium
PubChem CID160702408
Molecular FormulaC158H207F13N4O37S6
Molecular Weight3193.76 g/mol
Exact Mass3191.26
IUPAC Namebis(4-butan-2-ylphenol);3-[4-[4-(4-butan-2-ylphenoxy)-4-oxobutyl]sulfanylphenoxy]sulfonyl-1,1,2,2,3,3-hexafluoropropane-1-sulfonate;3-[4-[2-(4-butan-2-ylphenoxy)sulfonylethoxycarbonyl]phenoxy]sulfonyl-1,1,2,2,3,3-hexafluoropropane-1-sulfonate;(4-butan-2-ylphenyl) tert-butyl carbonate;(6-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2,2-dimethylbutanoate;[2-[(6-cyano-5-oxo-2-tricyclo[4.2.1.03,7]nonanyl)oxy]-2-oxoethyl] 2,2-dimethylbutanoate;3-cyclohexylpentan-3-yl 2,2-dimethylbutanoate;1-(2-ethylhexoxy)-2,4,6-trimethylpyridin-1-ium;4-fluoro-1-phenylmethoxypyridin-1-ium
SMILESCCC(C)(C)C(=O)OC(CC)(CC)C1CCCCC1.CCC(C)(C)C(=O)OC1C2CC3C1OC(=O)C3(C#N)C2.CCC(C)(C)C(=O)OCC(=O)OC1C2CC3C1CC(=O)C3(C#N)C2.CCC(C)c1ccc(O)cc1.CCC(C)c1ccc(O)cc1.CCC(C)c1ccc(OC(=O)CCCSc2ccc(OS(=O)(=O)C(F)(F)C(F)(F)C(F)(F)S(=O)(=O)[O-])cc2)cc1.CCC(C)c1ccc(OC(=O)OC(C)(C)C)cc1.CCC(C)c1ccc(OS(=O)(=O)CCOC(=O)c2ccc(OS(=O)(=O)C(F)(F)C(F)(F)C(F)(F)S(=O)(=O)[O-])cc2)cc1.CCCCC(CC)CO[n+]1c(C)cc(C)cc1C.Fc1cc[n+](OCc2ccccc2)cc1
InChIInChI=1S/C23H24F6O8S3.C22H22F6O11S3.C18H23NO5.C17H32O2.C16H28NO.C15H19NO4.C15H22O3.C12H11FNO.2C10H14O/c1-3-15(2)16-6-8-17(9-7-16)36-20(30)5-4-14-38-19-12-10-18(11-13-19)37-40(34,35)23(28,29)21(24,25)22(26,27)39(31,32)33;1-3-14(2)15-4-8-17(9-5-15)38-40(30,31)13-12-37-19(29)16-6-10-18(11-7-16)39-42(35,36)22(27,28)20(23,24)21(25,26)41(32,33)34;1-4-17(2,3)16(22)23-8-14(21)24-15-10-5-12-11(15)6-13(20)18(12,7-10)9-19;1-6-16(4,5)15(18)19-17(7-2,8-3)14-12-10-9-11-13-14;1-6-8-9-16(7-2)12-18-17-14(4)10-13(3)11-15(17)5;1-4-14(2,3)12(17)19-10-8-5-9-11(10)20-13(18)15(9,6-8)7-16;1-6-11(2)12-7-9-13(10-8-12)17-14(16)18-15(3,4)5;13-12-6-8-14(9-7-12)15-10-11-4-2-1-3-5-11;2*1-3-8(2)9-4-6-10(11)7-5-9/h6-13,15H,3-5,14H2,1-2H3,(H,31,32,33);4-11,14H,3,12-13H2,1-2H3,(H,32,33,34);10-12,15H,4-8H2,1-3H3;14H,6-13H2,1-5H3;10-11,16H,6-9,12H2,1-5H3;8-11H,4-6H2,1-3H3;7-11H,6H2,1-5H3;1-9H,10H2;2*4-8,11H,3H2,1-2H3/q;;;;+1;;;+1;;/p-2
InChIKeyRQUFSHOSKQPKOM-UHFFFAOYSA-L
XLogP34.14
TPSA595.47 Ų
H-Bond Donors2
H-Bond Acceptors40
Rotatable Bonds59
Heavy Atoms218
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003193.76
LogP ≤ 534.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1040

Computed Properties (RDKit)

Structural Alerts{'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}, {'alert_name': 'phenol_ester', 'substructure': 'N/A'}, {'alert_name': 'phenyl_carbonate', 'substructure': 'N/A'}

Analyze bis(4-butan-2-ylphenol);3-[4-[4-(4-butan-2-ylphenoxy)-4-oxobutyl]sulfanylphenoxy]sulfonyl-1,1,2,2,3,3-hexafluoropropane-1-sulfonate;3-[4-[2-(4-butan-2-ylphenoxy)sulfonylethoxycarbonyl]phenoxy]sulfonyl-1,1,2,2,3,3-hexafluoropropane-1-sulfonate;(4-butan-2-ylphenyl) tert-butyl carbonate;(6-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2,2-dimethylbutanoate;[2-[(6-cyano-5-oxo-2-tricyclo[4.2.1.03,7]nonanyl)oxy]-2-oxoethyl] 2,2-dimethylbutanoate;3-cyclohexylpentan-3-yl 2,2-dimethylbutanoate;1-(2-ethylhexoxy)-2,4,6-trimethylpyridin-1-ium;4-fluoro-1-phenylmethoxypyridin-1-ium with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of bis(4-butan-2-ylphenol);3-[4-[4-(4-butan-2-ylphenoxy)-4-oxobutyl]sulfanylphenoxy]sulfonyl-1,1,2,2,3,3-hexafluoropropane-1-sulfonate;3-[4-[2-(4-butan-2-ylphenoxy)sulfonylethoxycarbonyl]phenoxy]sulfonyl-1,1,2,2,3,3-hexafluoropropane-1-sulfonate;(4-butan-2-ylphenyl) tert-butyl carbonate;(6-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2,2-dimethylbutanoate;[2-[(6-cyano-5-oxo-2-tricyclo[4.2.1.03,7]nonanyl)oxy]-2-oxoethyl] 2,2-dimethylbutanoate;3-cyclohexylpentan-3-yl 2,2-dimethylbutanoate;1-(2-ethylhexoxy)-2,4,6-trimethylpyridin-1-ium;4-fluoro-1-phenylmethoxypyridin-1-ium?
The IUPAC name of bis(4-butan-2-ylphenol);3-[4-[4-(4-butan-2-ylphenoxy)-4-oxobutyl]sulfanylphenoxy]sulfonyl-1,1,2,2,3,3-hexafluoropropane-1-sulfonate;3-[4-[2-(4-butan-2-ylphenoxy)sulfonylethoxycarbonyl]phenoxy]sulfonyl-1,1,2,2,3,3-hexafluoropropane-1-sulfonate;(4-butan-2-ylphenyl) tert-butyl carbonate;(6-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2,2-dimethylbutanoate;[2-[(6-cyano-5-oxo-2-tricyclo[4.2.1.03,7]nonanyl)oxy]-2-oxoethyl] 2,2-dimethylbutanoate;3-cyclohexylpentan-3-yl 2,2-dimethylbutanoate;1-(2-ethylhexoxy)-2,4,6-trimethylpyridin-1-ium;4-fluoro-1-phenylmethoxypyridin-1-ium (CID 160702408) is bis(4-butan-2-ylphenol);3-[4-[4-(4-butan-2-ylphenoxy)-4-oxobutyl]sulfanylphenoxy]sulfonyl-1,1,2,2,3,3-hexafluoropropane-1-sulfonate;3-[4-[2-(4-butan-2-ylphenoxy)sulfonylethoxycarbonyl]phenoxy]sulfonyl-1,1,2,2,3,3-hexafluoropropane-1-sulfonate;(4-butan-2-ylphenyl) tert-butyl carbonate;(6-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2,2-dimethylbutanoate;[2-[(6-cyano-5-oxo-2-tricyclo[4.2.1.03,7]nonanyl)oxy]-2-oxoethyl] 2,2-dimethylbutanoate;3-cyclohexylpentan-3-yl 2,2-dimethylbutanoate;1-(2-ethylhexoxy)-2,4,6-trimethylpyridin-1-ium;4-fluoro-1-phenylmethoxypyridin-1-ium.
What is the SMILES notation for bis(4-butan-2-ylphenol);3-[4-[4-(4-butan-2-ylphenoxy)-4-oxobutyl]sulfanylphenoxy]sulfonyl-1,1,2,2,3,3-hexafluoropropane-1-sulfonate;3-[4-[2-(4-butan-2-ylphenoxy)sulfonylethoxycarbonyl]phenoxy]sulfonyl-1,1,2,2,3,3-hexafluoropropane-1-sulfonate;(4-butan-2-ylphenyl) tert-butyl carbonate;(6-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2,2-dimethylbutanoate;[2-[(6-cyano-5-oxo-2-tricyclo[4.2.1.03,7]nonanyl)oxy]-2-oxoethyl] 2,2-dimethylbutanoate;3-cyclohexylpentan-3-yl 2,2-dimethylbutanoate;1-(2-ethylhexoxy)-2,4,6-trimethylpyridin-1-ium;4-fluoro-1-phenylmethoxypyridin-1-ium?
The canonical SMILES for bis(4-butan-2-ylphenol);3-[4-[4-(4-butan-2-ylphenoxy)-4-oxobutyl]sulfanylphenoxy]sulfonyl-1,1,2,2,3,3-hexafluoropropane-1-sulfonate;3-[4-[2-(4-butan-2-ylphenoxy)sulfonylethoxycarbonyl]phenoxy]sulfonyl-1,1,2,2,3,3-hexafluoropropane-1-sulfonate;(4-butan-2-ylphenyl) tert-butyl carbonate;(6-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2,2-dimethylbutanoate;[2-[(6-cyano-5-oxo-2-tricyclo[4.2.1.03,7]nonanyl)oxy]-2-oxoethyl] 2,2-dimethylbutanoate;3-cyclohexylpentan-3-yl 2,2-dimethylbutanoate;1-(2-ethylhexoxy)-2,4,6-trimethylpyridin-1-ium;4-fluoro-1-phenylmethoxypyridin-1-ium is CCC(C)(C)C(=O)OC(CC)(CC)C1CCCCC1.CCC(C)(C)C(=O)OC1C2CC3C1OC(=O)C3(C#N)C2.CCC(C)(C)C(=O)OCC(=O)OC1C2CC3C1CC(=O)C3(C#N)C2.CCC(C)c1ccc(O)cc1.CCC(C)c1ccc(O)cc1.CCC(C)c1ccc(OC(=O)CCCSc2ccc(OS(=O)(=O)C(F)(F)C(F)(F)C(F)(F)S(=O)(=O)[O-])cc2)cc1.CCC(C)c1ccc(OC(=O)OC(C)(C)C)cc1.CCC(C)c1ccc(OS(=O)(=O)CCOC(=O)c2ccc(OS(=O)(=O)C(F)(F)C(F)(F)C(F)(F)S(=O)(=O)[O-])cc2)cc1.CCCCC(CC)CO[n+]1c(C)cc(C)cc1C.Fc1cc[n+](OCc2ccccc2)cc1.
What is the InChIKey of bis(4-butan-2-ylphenol);3-[4-[4-(4-butan-2-ylphenoxy)-4-oxobutyl]sulfanylphenoxy]sulfonyl-1,1,2,2,3,3-hexafluoropropane-1-sulfonate;3-[4-[2-(4-butan-2-ylphenoxy)sulfonylethoxycarbonyl]phenoxy]sulfonyl-1,1,2,2,3,3-hexafluoropropane-1-sulfonate;(4-butan-2-ylphenyl) tert-butyl carbonate;(6-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2,2-dimethylbutanoate;[2-[(6-cyano-5-oxo-2-tricyclo[4.2.1.03,7]nonanyl)oxy]-2-oxoethyl] 2,2-dimethylbutanoate;3-cyclohexylpentan-3-yl 2,2-dimethylbutanoate;1-(2-ethylhexoxy)-2,4,6-trimethylpyridin-1-ium;4-fluoro-1-phenylmethoxypyridin-1-ium?
The InChIKey is RQUFSHOSKQPKOM-UHFFFAOYSA-L. The full InChI is InChI=1S/C23H24F6O8S3.C22H22F6O11S3.C18H23NO5.C17H32O2.C16H28NO.C15H19NO4.C15H22O3.C12H11FNO.2C10H14O/c1-3-15(2)16-6-8-17(9-7-16)36-20(30)5-4-14-38-19-12-10-18(11-13-19)37-40(34,35)23(28,29)21(24,25)22(26,27)39(31,32)33;1-3-14(2)15-4-8-17(9-5-15)38-40(30,31)13-12-37-19(29)16-6-10-18(11-7-16)39-42(35,36)22(27,28)20(23,24)21(25,26)41(32,33)34;1-4-17(2,3)16(22)23-8-14(21)24-15-10-5-12-11(15)6-13(20)18(12,7-10)9-19;1-6-16(4,5)15(18)19-17(7-2,8-3)14-12-10-9-11-13-14;1-6-8-9-16(7-2)12-18-17-14(4)10-13(3)11-15(17)5;1-4-14(2,3)12(17)19-10-8-5-9-11(10)20-13(18)15(9,6-8)7-16;1-6-11(2)12-7-9-13(10-8-12)17-14(16)18-15(3,4)5;13-12-6-8-14(9-7-12)15-10-11-4-2-1-3-5-11;2*1-3-8(2)9-4-6-10(11)7-5-9/h6-13,15H,3-5,14H2,1-2H3,(H,31,32,33);4-11,14H,3,12-13H2,1-2H3,(H,32,33,34);10-12,15H,4-8H2,1-3H3;14H,6-13H2,1-5H3;10-11,16H,6-9,12H2,1-5H3;8-11H,4-6H2,1-3H3;7-11H,6H2,1-5H3;1-9H,10H2;2*4-8,11H,3H2,1-2H3/q;;;;+1;;;+1;;/p-2.
What are the key properties of bis(4-butan-2-ylphenol);3-[4-[4-(4-butan-2-ylphenoxy)-4-oxobutyl]sulfanylphenoxy]sulfonyl-1,1,2,2,3,3-hexafluoropropane-1-sulfonate;3-[4-[2-(4-butan-2-ylphenoxy)sulfonylethoxycarbonyl]phenoxy]sulfonyl-1,1,2,2,3,3-hexafluoropropane-1-sulfonate;(4-butan-2-ylphenyl) tert-butyl carbonate;(6-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2,2-dimethylbutanoate;[2-[(6-cyano-5-oxo-2-tricyclo[4.2.1.03,7]nonanyl)oxy]-2-oxoethyl] 2,2-dimethylbutanoate;3-cyclohexylpentan-3-yl 2,2-dimethylbutanoate;1-(2-ethylhexoxy)-2,4,6-trimethylpyridin-1-ium;4-fluoro-1-phenylmethoxypyridin-1-ium?
bis(4-butan-2-ylphenol);3-[4-[4-(4-butan-2-ylphenoxy)-4-oxobutyl]sulfanylphenoxy]sulfonyl-1,1,2,2,3,3-hexafluoropropane-1-sulfonate;3-[4-[2-(4-butan-2-ylphenoxy)sulfonylethoxycarbonyl]phenoxy]sulfonyl-1,1,2,2,3,3-hexafluoropropane-1-sulfonate;(4-butan-2-ylphenyl) tert-butyl carbonate;(6-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2,2-dimethylbutanoate;[2-[(6-cyano-5-oxo-2-tricyclo[4.2.1.03,7]nonanyl)oxy]-2-oxoethyl] 2,2-dimethylbutanoate;3-cyclohexylpentan-3-yl 2,2-dimethylbutanoate;1-(2-ethylhexoxy)-2,4,6-trimethylpyridin-1-ium;4-fluoro-1-phenylmethoxypyridin-1-ium has a molecular weight of 3193.76 g/mol, XLogP of 34.14, 59 rotatable bonds, 2 hydrogen bond donors, and 40 hydrogen bond acceptors.
Where does this data come from?
All data for bis(4-butan-2-ylphenol);3-[4-[4-(4-butan-2-ylphenoxy)-4-oxobutyl]sulfanylphenoxy]sulfonyl-1,1,2,2,3,3-hexafluoropropane-1-sulfonate;3-[4-[2-(4-butan-2-ylphenoxy)sulfonylethoxycarbonyl]phenoxy]sulfonyl-1,1,2,2,3,3-hexafluoropropane-1-sulfonate;(4-butan-2-ylphenyl) tert-butyl carbonate;(6-cyano-5-oxo-4-oxatricyclo[4.2.1.03,7]nonan-2-yl) 2,2-dimethylbutanoate;[2-[(6-cyano-5-oxo-2-tricyclo[4.2.1.03,7]nonanyl)oxy]-2-oxoethyl] 2,2-dimethylbutanoate;3-cyclohexylpentan-3-yl 2,2-dimethylbutanoate;1-(2-ethylhexoxy)-2,4,6-trimethylpyridin-1-ium;4-fluoro-1-phenylmethoxypyridin-1-ium is sourced from PubChem (CID 160702408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).