4-tert-butylbenzene-1,2,3-triol;4-tert-butyl-5-chloro-1-phenylpyrazole;6-tert-butyl-2,3-dihydro-1,4-benzodioxine;5-tert-butyl-2,3-dimethoxyphenol;4-tert-butyl-1-hydroxypyridin-1-ium;5-tert-butyl-1H-imidazole;3-tert-butyl-1H-indole;1-tert-butyl-3-methoxybenzene;4-tert-butyl-2-methoxy-6-nitrophenol;1-tert-butyl-3-nitrobenzene;3-tert-butyl-5-phenylmethoxy-1H-indole;2-tert-butylpyridine;4-tert-butylpyridine;2-tert-butyl-1H-pyrrole;2-tert-butylquinoline;1-tert-butyl-3-(trifluoromethoxy)benzene;methane

C177H240ClF3N13O18+ — CID 157109928

IUPAC4-tert-butylbenzene-1,2,3-triol;4-tert-butyl-5-chloro-1-phenylpyrazole;6-tert-butyl-2,3-dihydro-1,4-benzodioxine;5-tert-butyl-2,3-dimethoxyphenol;4-tert-butyl-1-hydroxypyridin-1-ium;5-tert-butyl-1H-imidazole;3-tert-butyl-1H-indole;1-tert-butyl-3-methoxybenzene;4-tert-butyl-2-methoxy-6-nitrophenol;1-tert-butyl-3-nitrobenzene;3-tert-butyl-5-phenylmethoxy-1H-indole;2-tert-butylpyridine;4-tert-butylpyridine;2-tert-butyl-1H-pyrrole;2-tert-butylquinoline;1-tert-butyl-3-(trifluoromethoxy)benzene;methane
SMILESC.CC(C)(C)c1c[nH]c2ccc(OCc3ccccc3)cc12.CC(C)(C)c1c[nH]c2ccccc12.CC(C)(C)c1cc[n+](O)cc1.CC(C)(C)c1ccc(O)c(O)c1O.CC(C)(C)c1ccc2c(c1)OCCO2.CC(C)(C)c1ccc2ccccc2n1.CC(C)(C)c1ccc[nH]1.CC(C)(C)c1cccc(OC(F)(F)F)c1.CC(C)(C)c1cccc([N+](=O)[O-])c1.CC(C)(C)c1ccccn1.CC(C)(C)c1ccncc1.CC(C)(C)c1cnc[nH]1.CC(C)(C)c1cnn(-c2ccccc2)c1Cl.COc1cc(C(C)(C)C)cc(O)c1OC.COc1cc(C(C)(C)C)cc([N+](=O)[O-])c1O.COc1cccc(C(C)(C)C)c1
InChIInChI=1S/C19H21NO.C13H15ClN2.C13H15N.C12H15N.C12H18O3.C12H16O2.C11H13F3O.C11H15NO4.C11H16O.C10H13NO2.C10H14O3.C9H14NO.2C9H13N.C8H13N.C7H12N2.CH4/c1-19(2,3)17-12-20-18-10-9-15(11-16(17)18)21-13-14-7-5-4-6-8-14;1-13(2,3)11-9-15-16(12(11)14)10-7-5-4-6-8-10;1-13(2,3)12-9-8-10-6-4-5-7-11(10)14-12;1-12(2,3)10-8-13-11-7-5-4-6-9(10)11;1-12(2,3)8-6-9(13)11(15-5)10(7-8)14-4;1-12(2,3)9-4-5-10-11(8-9)14-7-6-13-10;1-10(2,3)8-5-4-6-9(7-8)15-11(12,13)14;1-11(2,3)7-5-8(12(14)15)10(13)9(6-7)16-4;1-11(2,3)9-6-5-7-10(8-9)12-4;1-10(2,3)8-5-4-6-9(7-8)11(12)13;1-10(2,3)6-4-5-7(11)9(13)8(6)12;1-9(2,3)8-4-6-10(11)7-5-8;1-9(2,3)8-4-6-10-7-5-8;1-9(2,3)8-6-4-5-7-10-8;1-8(2,3)7-5-4-6-9-7;1-7(2,3)6-4-8-5-9-6;/h4-12,20H,13H2,1-3H3;4-9H,1-3H3;4-9H,1-3H3;4-8,13H,1-3H3;6-7,13H,1-5H3;4-5,8H,6-7H2,1-3H3;4-7H,1-3H3;5-6,13H,1-4H3;5-8H,1-4H3;4-7H,1-3H3;4-5,11-13H,1-3H3;4-7,11H,1-3H3;2*4-7H,1-3H3;4-6,9H,1-3H3;4-5H,1-3H3,(H,8,9);1H4/q;;;;;;;;;;;+1;;;;;
InChIKeyJNJIMKVAENLSJK-UHFFFAOYSA-N
MW2930.39 g/mol
LogP46.73
Rot. Bonds11

About 4-tert-butylbenzene-1,2,3-triol;4-tert-butyl-5-chloro-1-phenylpyrazole;6-tert-butyl-2,3-dihydro-1,4-benzodioxine;5-tert-butyl-2,3-dimethoxyphenol;4-tert-butyl-1-hydroxypyridin-1-ium;5-tert-butyl-1H-imidazole;3-tert-butyl-1H-indole;1-tert-butyl-3-methoxybenzene;4-tert-butyl-2-methoxy-6-nitrophenol;1-tert-butyl-3-nitrobenzene;3-tert-butyl-5-phenylmethoxy-1H-indole;2-tert-butylpyridine;4-tert-butylpyridine;2-tert-butyl-1H-pyrrole;2-tert-butylquinoline;1-tert-butyl-3-(trifluoromethoxy)benzene;methane

4-tert-butylbenzene-1,2,3-triol;4-tert-butyl-5-chloro-1-phenylpyrazole;6-tert-butyl-2,3-dihydro-1,4-benzodioxine;5-tert-butyl-2,3-dimethoxyphenol;4-tert-butyl-1-hydroxypyridin-1-ium;5-tert-butyl-1H-imidazole;3-tert-butyl-1H-indole;1-tert-butyl-3-methoxybenzene;4-tert-butyl-2-methoxy-6-nitrophenol;1-tert-butyl-3-nitrobenzene;3-tert-butyl-5-phenylmethoxy-1H-indole;2-tert-butylpyridine;4-tert-butylpyridine;2-tert-butyl-1H-pyrrole;2-tert-butylquinoline;1-tert-butyl-3-(trifluoromethoxy)benzene;methane (PubChem CID 157109928) has the molecular formula C177H240ClF3N13O18+ and a molecular weight of 2930.39 g/mol. Its IUPAC name is 4-tert-butylbenzene-1,2,3-triol;4-tert-butyl-5-chloro-1-phenylpyrazole;6-tert-butyl-2,3-dihydro-1,4-benzodioxine;5-tert-butyl-2,3-dimethoxyphenol;4-tert-butyl-1-hydroxypyridin-1-ium;5-tert-butyl-1H-imidazole;3-tert-butyl-1H-indole;1-tert-butyl-3-methoxybenzene;4-tert-butyl-2-methoxy-6-nitrophenol;1-tert-butyl-3-nitrobenzene;3-tert-butyl-5-phenylmethoxy-1H-indole;2-tert-butylpyridine;4-tert-butylpyridine;2-tert-butyl-1H-pyrrole;2-tert-butylquinoline;1-tert-butyl-3-(trifluoromethoxy)benzene;methane.

Molecular Properties

Compound Name4-tert-butylbenzene-1,2,3-triol;4-tert-butyl-5-chloro-1-phenylpyrazole;6-tert-butyl-2,3-dihydro-1,4-benzodioxine;5-tert-butyl-2,3-dimethoxyphenol;4-tert-butyl-1-hydroxypyridin-1-ium;5-tert-butyl-1H-imidazole;3-tert-butyl-1H-indole;1-tert-butyl-3-methoxybenzene;4-tert-butyl-2-methoxy-6-nitrophenol;1-tert-butyl-3-nitrobenzene;3-tert-butyl-5-phenylmethoxy-1H-indole;2-tert-butylpyridine;4-tert-butylpyridine;2-tert-butyl-1H-pyrrole;2-tert-butylquinoline;1-tert-butyl-3-(trifluoromethoxy)benzene;methane
PubChem CID157109928
Molecular FormulaC177H240ClF3N13O18+
Molecular Weight2930.39 g/mol
Exact Mass2927.79
IUPAC Name4-tert-butylbenzene-1,2,3-triol;4-tert-butyl-5-chloro-1-phenylpyrazole;6-tert-butyl-2,3-dihydro-1,4-benzodioxine;5-tert-butyl-2,3-dimethoxyphenol;4-tert-butyl-1-hydroxypyridin-1-ium;5-tert-butyl-1H-imidazole;3-tert-butyl-1H-indole;1-tert-butyl-3-methoxybenzene;4-tert-butyl-2-methoxy-6-nitrophenol;1-tert-butyl-3-nitrobenzene;3-tert-butyl-5-phenylmethoxy-1H-indole;2-tert-butylpyridine;4-tert-butylpyridine;2-tert-butyl-1H-pyrrole;2-tert-butylquinoline;1-tert-butyl-3-(trifluoromethoxy)benzene;methane
SMILESC.CC(C)(C)c1c[nH]c2ccc(OCc3ccccc3)cc12.CC(C)(C)c1c[nH]c2ccccc12.CC(C)(C)c1cc[n+](O)cc1.CC(C)(C)c1ccc(O)c(O)c1O.CC(C)(C)c1ccc2c(c1)OCCO2.CC(C)(C)c1ccc2ccccc2n1.CC(C)(C)c1ccc[nH]1.CC(C)(C)c1cccc(OC(F)(F)F)c1.CC(C)(C)c1cccc([N+](=O)[O-])c1.CC(C)(C)c1ccccn1.CC(C)(C)c1ccncc1.CC(C)(C)c1cnc[nH]1.CC(C)(C)c1cnn(-c2ccccc2)c1Cl.COc1cc(C(C)(C)C)cc(O)c1OC.COc1cc(C(C)(C)C)cc([N+](=O)[O-])c1O.COc1cccc(C(C)(C)C)c1
InChIInChI=1S/C19H21NO.C13H15ClN2.C13H15N.C12H15N.C12H18O3.C12H16O2.C11H13F3O.C11H15NO4.C11H16O.C10H13NO2.C10H14O3.C9H14NO.2C9H13N.C8H13N.C7H12N2.CH4/c1-19(2,3)17-12-20-18-10-9-15(11-16(17)18)21-13-14-7-5-4-6-8-14;1-13(2,3)11-9-15-16(12(11)14)10-7-5-4-6-8-10;1-13(2,3)12-9-8-10-6-4-5-7-11(10)14-12;1-12(2,3)10-8-13-11-7-5-4-6-9(10)11;1-12(2,3)8-6-9(13)11(15-5)10(7-8)14-4;1-12(2,3)9-4-5-10-11(8-9)14-7-6-13-10;1-10(2,3)8-5-4-6-9(7-8)15-11(12,13)14;1-11(2,3)7-5-8(12(14)15)10(13)9(6-7)16-4;1-11(2,3)9-6-5-7-10(8-9)12-4;1-10(2,3)8-5-4-6-9(7-8)11(12)13;1-10(2,3)6-4-5-7(11)9(13)8(6)12;1-9(2,3)8-4-6-10(11)7-5-8;1-9(2,3)8-4-6-10-7-5-8;1-9(2,3)8-6-4-5-7-10-8;1-8(2,3)7-5-4-6-9-7;1-7(2,3)6-4-8-5-9-6;/h4-12,20H,13H2,1-3H3;4-9H,1-3H3;4-9H,1-3H3;4-8,13H,1-3H3;6-7,13H,1-5H3;4-5,8H,6-7H2,1-3H3;4-7H,1-3H3;5-6,13H,1-4H3;5-8H,1-4H3;4-7H,1-3H3;4-5,11-13H,1-3H3;4-7,11H,1-3H3;2*4-7H,1-3H3;4-6,9H,1-3H3;4-5H,1-3H3,(H,8,9);1H4/q;;;;;;;;;;;+1;;;;;
InChIKeyJNJIMKVAENLSJK-UHFFFAOYSA-N
XLogP46.73
TPSA417.92 Ų
H-Bond Donors10
H-Bond Acceptors24
Rotatable Bonds11
Heavy Atoms212
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002930.39
LogP ≤ 546.73
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1024

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'catechol_A(92)', 'substructure': 'N/A'}, {'alert_name': 'catechol', 'substructure': 'N/A'}, {'alert_name': 'N-hydroxyl_pyridine', 'substructure': 'N/A'}, {'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 4-tert-butylbenzene-1,2,3-triol;4-tert-butyl-5-chloro-1-phenylpyrazole;6-tert-butyl-2,3-dihydro-1,4-benzodioxine;5-tert-butyl-2,3-dimethoxyphenol;4-tert-butyl-1-hydroxypyridin-1-ium;5-tert-butyl-1H-imidazole;3-tert-butyl-1H-indole;1-tert-butyl-3-methoxybenzene;4-tert-butyl-2-methoxy-6-nitrophenol;1-tert-butyl-3-nitrobenzene;3-tert-butyl-5-phenylmethoxy-1H-indole;2-tert-butylpyridine;4-tert-butylpyridine;2-tert-butyl-1H-pyrrole;2-tert-butylquinoline;1-tert-butyl-3-(trifluoromethoxy)benzene;methane with MolForge

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Related Compounds

4-chloro-5-fluoroquinazoline;3,3-difluoro-1-methylpiperidin-4-ol;bis(5-(3,3-difluoro-1-methylpiperidin-4-yl)oxy-7-methoxy-N-(3-methyl-4-pyrazolo[1,5-a]pyridin-6-yloxyphenyl)quinazolin-4-amine);1-fluoro-2-methyl-4-nitrobenzene;5-fluoro-N-(3-methyl-4-pyrazolo[1,5-a]pyridin-6-yloxyphenyl)quinazolin-4-amine;6-(2-methyl-4-nitrophenoxy)pyrazolo[1,5-a]pyridine;3-methyl-4-pyrazolo[1,5-a]pyridin-6-yloxyaniline;pyrazolo[1,5-a]pyridin-6-ol
CID 158346985
4-tert-butyl-5-chloro-1-phenylpyrazole;6-tert-butyl-2,3-dihydro-1,4-benzodioxine;4-tert-butyl-1-hydroxypyridin-1-ium;3-tert-butyl-1H-indole;4-tert-butyl-5-methyl-1H-imidazole;3-tert-butyl-5-phenylmethoxy-1H-indole;2-tert-butylpyridine;4-tert-butylpyridine
CID 157744377

Frequently Asked Questions

What is the IUPAC name of 4-tert-butylbenzene-1,2,3-triol;4-tert-butyl-5-chloro-1-phenylpyrazole;6-tert-butyl-2,3-dihydro-1,4-benzodioxine;5-tert-butyl-2,3-dimethoxyphenol;4-tert-butyl-1-hydroxypyridin-1-ium;5-tert-butyl-1H-imidazole;3-tert-butyl-1H-indole;1-tert-butyl-3-methoxybenzene;4-tert-butyl-2-methoxy-6-nitrophenol;1-tert-butyl-3-nitrobenzene;3-tert-butyl-5-phenylmethoxy-1H-indole;2-tert-butylpyridine;4-tert-butylpyridine;2-tert-butyl-1H-pyrrole;2-tert-butylquinoline;1-tert-butyl-3-(trifluoromethoxy)benzene;methane?
The IUPAC name of 4-tert-butylbenzene-1,2,3-triol;4-tert-butyl-5-chloro-1-phenylpyrazole;6-tert-butyl-2,3-dihydro-1,4-benzodioxine;5-tert-butyl-2,3-dimethoxyphenol;4-tert-butyl-1-hydroxypyridin-1-ium;5-tert-butyl-1H-imidazole;3-tert-butyl-1H-indole;1-tert-butyl-3-methoxybenzene;4-tert-butyl-2-methoxy-6-nitrophenol;1-tert-butyl-3-nitrobenzene;3-tert-butyl-5-phenylmethoxy-1H-indole;2-tert-butylpyridine;4-tert-butylpyridine;2-tert-butyl-1H-pyrrole;2-tert-butylquinoline;1-tert-butyl-3-(trifluoromethoxy)benzene;methane (CID 157109928) is 4-tert-butylbenzene-1,2,3-triol;4-tert-butyl-5-chloro-1-phenylpyrazole;6-tert-butyl-2,3-dihydro-1,4-benzodioxine;5-tert-butyl-2,3-dimethoxyphenol;4-tert-butyl-1-hydroxypyridin-1-ium;5-tert-butyl-1H-imidazole;3-tert-butyl-1H-indole;1-tert-butyl-3-methoxybenzene;4-tert-butyl-2-methoxy-6-nitrophenol;1-tert-butyl-3-nitrobenzene;3-tert-butyl-5-phenylmethoxy-1H-indole;2-tert-butylpyridine;4-tert-butylpyridine;2-tert-butyl-1H-pyrrole;2-tert-butylquinoline;1-tert-butyl-3-(trifluoromethoxy)benzene;methane.
What is the SMILES notation for 4-tert-butylbenzene-1,2,3-triol;4-tert-butyl-5-chloro-1-phenylpyrazole;6-tert-butyl-2,3-dihydro-1,4-benzodioxine;5-tert-butyl-2,3-dimethoxyphenol;4-tert-butyl-1-hydroxypyridin-1-ium;5-tert-butyl-1H-imidazole;3-tert-butyl-1H-indole;1-tert-butyl-3-methoxybenzene;4-tert-butyl-2-methoxy-6-nitrophenol;1-tert-butyl-3-nitrobenzene;3-tert-butyl-5-phenylmethoxy-1H-indole;2-tert-butylpyridine;4-tert-butylpyridine;2-tert-butyl-1H-pyrrole;2-tert-butylquinoline;1-tert-butyl-3-(trifluoromethoxy)benzene;methane?
The canonical SMILES for 4-tert-butylbenzene-1,2,3-triol;4-tert-butyl-5-chloro-1-phenylpyrazole;6-tert-butyl-2,3-dihydro-1,4-benzodioxine;5-tert-butyl-2,3-dimethoxyphenol;4-tert-butyl-1-hydroxypyridin-1-ium;5-tert-butyl-1H-imidazole;3-tert-butyl-1H-indole;1-tert-butyl-3-methoxybenzene;4-tert-butyl-2-methoxy-6-nitrophenol;1-tert-butyl-3-nitrobenzene;3-tert-butyl-5-phenylmethoxy-1H-indole;2-tert-butylpyridine;4-tert-butylpyridine;2-tert-butyl-1H-pyrrole;2-tert-butylquinoline;1-tert-butyl-3-(trifluoromethoxy)benzene;methane is C.CC(C)(C)c1c[nH]c2ccc(OCc3ccccc3)cc12.CC(C)(C)c1c[nH]c2ccccc12.CC(C)(C)c1cc[n+](O)cc1.CC(C)(C)c1ccc(O)c(O)c1O.CC(C)(C)c1ccc2c(c1)OCCO2.CC(C)(C)c1ccc2ccccc2n1.CC(C)(C)c1ccc[nH]1.CC(C)(C)c1cccc(OC(F)(F)F)c1.CC(C)(C)c1cccc([N+](=O)[O-])c1.CC(C)(C)c1ccccn1.CC(C)(C)c1ccncc1.CC(C)(C)c1cnc[nH]1.CC(C)(C)c1cnn(-c2ccccc2)c1Cl.COc1cc(C(C)(C)C)cc(O)c1OC.COc1cc(C(C)(C)C)cc([N+](=O)[O-])c1O.COc1cccc(C(C)(C)C)c1.
What is the InChIKey of 4-tert-butylbenzene-1,2,3-triol;4-tert-butyl-5-chloro-1-phenylpyrazole;6-tert-butyl-2,3-dihydro-1,4-benzodioxine;5-tert-butyl-2,3-dimethoxyphenol;4-tert-butyl-1-hydroxypyridin-1-ium;5-tert-butyl-1H-imidazole;3-tert-butyl-1H-indole;1-tert-butyl-3-methoxybenzene;4-tert-butyl-2-methoxy-6-nitrophenol;1-tert-butyl-3-nitrobenzene;3-tert-butyl-5-phenylmethoxy-1H-indole;2-tert-butylpyridine;4-tert-butylpyridine;2-tert-butyl-1H-pyrrole;2-tert-butylquinoline;1-tert-butyl-3-(trifluoromethoxy)benzene;methane?
The InChIKey is JNJIMKVAENLSJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21NO.C13H15ClN2.C13H15N.C12H15N.C12H18O3.C12H16O2.C11H13F3O.C11H15NO4.C11H16O.C10H13NO2.C10H14O3.C9H14NO.2C9H13N.C8H13N.C7H12N2.CH4/c1-19(2,3)17-12-20-18-10-9-15(11-16(17)18)21-13-14-7-5-4-6-8-14;1-13(2,3)11-9-15-16(12(11)14)10-7-5-4-6-8-10;1-13(2,3)12-9-8-10-6-4-5-7-11(10)14-12;1-12(2,3)10-8-13-11-7-5-4-6-9(10)11;1-12(2,3)8-6-9(13)11(15-5)10(7-8)14-4;1-12(2,3)9-4-5-10-11(8-9)14-7-6-13-10;1-10(2,3)8-5-4-6-9(7-8)15-11(12,13)14;1-11(2,3)7-5-8(12(14)15)10(13)9(6-7)16-4;1-11(2,3)9-6-5-7-10(8-9)12-4;1-10(2,3)8-5-4-6-9(7-8)11(12)13;1-10(2,3)6-4-5-7(11)9(13)8(6)12;1-9(2,3)8-4-6-10(11)7-5-8;1-9(2,3)8-4-6-10-7-5-8;1-9(2,3)8-6-4-5-7-10-8;1-8(2,3)7-5-4-6-9-7;1-7(2,3)6-4-8-5-9-6;/h4-12,20H,13H2,1-3H3;4-9H,1-3H3;4-9H,1-3H3;4-8,13H,1-3H3;6-7,13H,1-5H3;4-5,8H,6-7H2,1-3H3;4-7H,1-3H3;5-6,13H,1-4H3;5-8H,1-4H3;4-7H,1-3H3;4-5,11-13H,1-3H3;4-7,11H,1-3H3;2*4-7H,1-3H3;4-6,9H,1-3H3;4-5H,1-3H3,(H,8,9);1H4/q;;;;;;;;;;;+1;;;;;.
What are the key properties of 4-tert-butylbenzene-1,2,3-triol;4-tert-butyl-5-chloro-1-phenylpyrazole;6-tert-butyl-2,3-dihydro-1,4-benzodioxine;5-tert-butyl-2,3-dimethoxyphenol;4-tert-butyl-1-hydroxypyridin-1-ium;5-tert-butyl-1H-imidazole;3-tert-butyl-1H-indole;1-tert-butyl-3-methoxybenzene;4-tert-butyl-2-methoxy-6-nitrophenol;1-tert-butyl-3-nitrobenzene;3-tert-butyl-5-phenylmethoxy-1H-indole;2-tert-butylpyridine;4-tert-butylpyridine;2-tert-butyl-1H-pyrrole;2-tert-butylquinoline;1-tert-butyl-3-(trifluoromethoxy)benzene;methane?
4-tert-butylbenzene-1,2,3-triol;4-tert-butyl-5-chloro-1-phenylpyrazole;6-tert-butyl-2,3-dihydro-1,4-benzodioxine;5-tert-butyl-2,3-dimethoxyphenol;4-tert-butyl-1-hydroxypyridin-1-ium;5-tert-butyl-1H-imidazole;3-tert-butyl-1H-indole;1-tert-butyl-3-methoxybenzene;4-tert-butyl-2-methoxy-6-nitrophenol;1-tert-butyl-3-nitrobenzene;3-tert-butyl-5-phenylmethoxy-1H-indole;2-tert-butylpyridine;4-tert-butylpyridine;2-tert-butyl-1H-pyrrole;2-tert-butylquinoline;1-tert-butyl-3-(trifluoromethoxy)benzene;methane has a molecular weight of 2930.39 g/mol, XLogP of 46.73, 11 rotatable bonds, 10 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for 4-tert-butylbenzene-1,2,3-triol;4-tert-butyl-5-chloro-1-phenylpyrazole;6-tert-butyl-2,3-dihydro-1,4-benzodioxine;5-tert-butyl-2,3-dimethoxyphenol;4-tert-butyl-1-hydroxypyridin-1-ium;5-tert-butyl-1H-imidazole;3-tert-butyl-1H-indole;1-tert-butyl-3-methoxybenzene;4-tert-butyl-2-methoxy-6-nitrophenol;1-tert-butyl-3-nitrobenzene;3-tert-butyl-5-phenylmethoxy-1H-indole;2-tert-butylpyridine;4-tert-butylpyridine;2-tert-butyl-1H-pyrrole;2-tert-butylquinoline;1-tert-butyl-3-(trifluoromethoxy)benzene;methane is sourced from PubChem (CID 157109928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).