1-tert-butyl-4-[2-(3,3-dimethylbutoxy)ethoxy]benzene;1-tert-butyl-4-[2-[2-(3,3-dimethylbutoxy)ethoxy]ethoxy]benzene;1-tert-butyl-4-[2-(2,2-dimethylpropoxy)ethoxy]benzene;1-tert-butyl-4-[2-[2-(2,2-dimethylpropoxy)ethoxy]ethoxy]benzene;bis(1-tert-butyl-4-[2-[2-[2-(2,2-dimethylpropoxy)ethoxy]ethoxy]ethoxy]benzene);1-tert-butyl-4-[2-[(2-methylpropan-2-yl)oxy]ethoxy]benzene;1-tert-butyl-4-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]benzene;1-tert-butyl-4-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethoxy]benzene;1-tert-butyl-4-(2-piperidin-1-ylethyl)piperidine

C186H318N2O27 — CID 159007914

IUPAC1-tert-butyl-4-[2-(3,3-dimethylbutoxy)ethoxy]benzene;1-tert-butyl-4-[2-[2-(3,3-dimethylbutoxy)ethoxy]ethoxy]benzene;1-tert-butyl-4-[2-(2,2-dimethylpropoxy)ethoxy]benzene;1-tert-butyl-4-[2-[2-(2,2-dimethylpropoxy)ethoxy]ethoxy]benzene;bis(1-tert-butyl-4-[2-[2-[2-(2,2-dimethylpropoxy)ethoxy]ethoxy]ethoxy]benzene);1-tert-butyl-4-[2-[(2-methylpropan-2-yl)oxy]ethoxy]benzene;1-tert-butyl-4-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]benzene;1-tert-butyl-4-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethoxy]benzene;1-tert-butyl-4-(2-piperidin-1-ylethyl)piperidine
SMILESCC(C)(C)CCOCCOCCOc1ccc(C(C)(C)C)cc1.CC(C)(C)CCOCCOc1ccc(C(C)(C)C)cc1.CC(C)(C)COCCOCCOCCOc1ccc(C(C)(C)C)cc1.CC(C)(C)COCCOCCOCCOc1ccc(C(C)(C)C)cc1.CC(C)(C)COCCOCCOc1ccc(C(C)(C)C)cc1.CC(C)(C)COCCOc1ccc(C(C)(C)C)cc1.CC(C)(C)N1CCC(CCN2CCCCC2)CC1.CC(C)(C)OCCOCCOCCOc1ccc(C(C)(C)C)cc1.CC(C)(C)OCCOCCOc1ccc(C(C)(C)C)cc1.CC(C)(C)OCCOc1ccc(C(C)(C)C)cc1
InChIInChI=1S/2C21H36O4.C20H34O4.C20H34O3.C19H32O3.C18H30O3.C18H30O2.C17H28O2.C16H32N2.C16H26O2/c2*1-20(2,3)17-24-14-13-22-11-12-23-15-16-25-19-9-7-18(8-10-19)21(4,5)6;1-19(2,3)17-7-9-18(10-8-17)23-15-13-21-11-12-22-14-16-24-20(4,5)6;1-19(2,3)11-12-21-13-14-22-15-16-23-18-9-7-17(8-10-18)20(4,5)6;1-18(2,3)15-21-12-11-20-13-14-22-17-9-7-16(8-10-17)19(4,5)6;1-17(2,3)15-7-9-16(10-8-15)20-13-11-19-12-14-21-18(4,5)6;1-17(2,3)11-12-19-13-14-20-16-9-7-15(8-10-16)18(4,5)6;1-16(2,3)13-18-11-12-19-15-9-7-14(8-10-15)17(4,5)6;1-16(2,3)18-13-8-15(9-14-18)7-12-17-10-5-4-6-11-17;1-15(2,3)13-7-9-14(10-8-13)17-11-12-18-16(4,5)6/h2*7-10H,11-17H2,1-6H3;7-10H,11-16H2,1-6H3;7-10H,11-16H2,1-6H3;7-10H,11-15H2,1-6H3;7-10H,11-14H2,1-6H3;7-10H,11-14H2,1-6H3;7-10H,11-13H2,1-6H3;15H,4-14H2,1-3H3;7-10H,11-12H2,1-6H3
InChIKeyJSDNGUSGXICSBP-UHFFFAOYSA-N
MW3014.58 g/mol
LogP43.39
Rot. Bonds74

About 1-tert-butyl-4-[2-(3,3-dimethylbutoxy)ethoxy]benzene;1-tert-butyl-4-[2-[2-(3,3-dimethylbutoxy)ethoxy]ethoxy]benzene;1-tert-butyl-4-[2-(2,2-dimethylpropoxy)ethoxy]benzene;1-tert-butyl-4-[2-[2-(2,2-dimethylpropoxy)ethoxy]ethoxy]benzene;bis(1-tert-butyl-4-[2-[2-[2-(2,2-dimethylpropoxy)ethoxy]ethoxy]ethoxy]benzene);1-tert-butyl-4-[2-[(2-methylpropan-2-yl)oxy]ethoxy]benzene;1-tert-butyl-4-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]benzene;1-tert-butyl-4-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethoxy]benzene;1-tert-butyl-4-(2-piperidin-1-ylethyl)piperidine

1-tert-butyl-4-[2-(3,3-dimethylbutoxy)ethoxy]benzene;1-tert-butyl-4-[2-[2-(3,3-dimethylbutoxy)ethoxy]ethoxy]benzene;1-tert-butyl-4-[2-(2,2-dimethylpropoxy)ethoxy]benzene;1-tert-butyl-4-[2-[2-(2,2-dimethylpropoxy)ethoxy]ethoxy]benzene;bis(1-tert-butyl-4-[2-[2-[2-(2,2-dimethylpropoxy)ethoxy]ethoxy]ethoxy]benzene);1-tert-butyl-4-[2-[(2-methylpropan-2-yl)oxy]ethoxy]benzene;1-tert-butyl-4-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]benzene;1-tert-butyl-4-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethoxy]benzene;1-tert-butyl-4-(2-piperidin-1-ylethyl)piperidine (PubChem CID 159007914) has the molecular formula C186H318N2O27 and a molecular weight of 3014.58 g/mol. Its IUPAC name is 1-tert-butyl-4-[2-(3,3-dimethylbutoxy)ethoxy]benzene;1-tert-butyl-4-[2-[2-(3,3-dimethylbutoxy)ethoxy]ethoxy]benzene;1-tert-butyl-4-[2-(2,2-dimethylpropoxy)ethoxy]benzene;1-tert-butyl-4-[2-[2-(2,2-dimethylpropoxy)ethoxy]ethoxy]benzene;bis(1-tert-butyl-4-[2-[2-[2-(2,2-dimethylpropoxy)ethoxy]ethoxy]ethoxy]benzene);1-tert-butyl-4-[2-[(2-methylpropan-2-yl)oxy]ethoxy]benzene;1-tert-butyl-4-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]benzene;1-tert-butyl-4-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethoxy]benzene;1-tert-butyl-4-(2-piperidin-1-ylethyl)piperidine.

Molecular Properties

Compound Name1-tert-butyl-4-[2-(3,3-dimethylbutoxy)ethoxy]benzene;1-tert-butyl-4-[2-[2-(3,3-dimethylbutoxy)ethoxy]ethoxy]benzene;1-tert-butyl-4-[2-(2,2-dimethylpropoxy)ethoxy]benzene;1-tert-butyl-4-[2-[2-(2,2-dimethylpropoxy)ethoxy]ethoxy]benzene;bis(1-tert-butyl-4-[2-[2-[2-(2,2-dimethylpropoxy)ethoxy]ethoxy]ethoxy]benzene);1-tert-butyl-4-[2-[(2-methylpropan-2-yl)oxy]ethoxy]benzene;1-tert-butyl-4-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]benzene;1-tert-butyl-4-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethoxy]benzene;1-tert-butyl-4-(2-piperidin-1-ylethyl)piperidine
PubChem CID159007914
Molecular FormulaC186H318N2O27
Molecular Weight3014.58 g/mol
Exact Mass3012.36
IUPAC Name1-tert-butyl-4-[2-(3,3-dimethylbutoxy)ethoxy]benzene;1-tert-butyl-4-[2-[2-(3,3-dimethylbutoxy)ethoxy]ethoxy]benzene;1-tert-butyl-4-[2-(2,2-dimethylpropoxy)ethoxy]benzene;1-tert-butyl-4-[2-[2-(2,2-dimethylpropoxy)ethoxy]ethoxy]benzene;bis(1-tert-butyl-4-[2-[2-[2-(2,2-dimethylpropoxy)ethoxy]ethoxy]ethoxy]benzene);1-tert-butyl-4-[2-[(2-methylpropan-2-yl)oxy]ethoxy]benzene;1-tert-butyl-4-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]benzene;1-tert-butyl-4-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethoxy]benzene;1-tert-butyl-4-(2-piperidin-1-ylethyl)piperidine
SMILESCC(C)(C)CCOCCOCCOc1ccc(C(C)(C)C)cc1.CC(C)(C)CCOCCOc1ccc(C(C)(C)C)cc1.CC(C)(C)COCCOCCOCCOc1ccc(C(C)(C)C)cc1.CC(C)(C)COCCOCCOCCOc1ccc(C(C)(C)C)cc1.CC(C)(C)COCCOCCOc1ccc(C(C)(C)C)cc1.CC(C)(C)COCCOc1ccc(C(C)(C)C)cc1.CC(C)(C)N1CCC(CCN2CCCCC2)CC1.CC(C)(C)OCCOCCOCCOc1ccc(C(C)(C)C)cc1.CC(C)(C)OCCOCCOc1ccc(C(C)(C)C)cc1.CC(C)(C)OCCOc1ccc(C(C)(C)C)cc1
InChIInChI=1S/2C21H36O4.C20H34O4.C20H34O3.C19H32O3.C18H30O3.C18H30O2.C17H28O2.C16H32N2.C16H26O2/c2*1-20(2,3)17-24-14-13-22-11-12-23-15-16-25-19-9-7-18(8-10-19)21(4,5)6;1-19(2,3)17-7-9-18(10-8-17)23-15-13-21-11-12-22-14-16-24-20(4,5)6;1-19(2,3)11-12-21-13-14-22-15-16-23-18-9-7-17(8-10-18)20(4,5)6;1-18(2,3)15-21-12-11-20-13-14-22-17-9-7-16(8-10-17)19(4,5)6;1-17(2,3)15-7-9-16(10-8-15)20-13-11-19-12-14-21-18(4,5)6;1-17(2,3)11-12-19-13-14-20-16-9-7-15(8-10-16)18(4,5)6;1-16(2,3)13-18-11-12-19-15-9-7-14(8-10-15)17(4,5)6;1-16(2,3)18-13-8-15(9-14-18)7-12-17-10-5-4-6-11-17;1-15(2,3)13-7-9-14(10-8-13)17-11-12-18-16(4,5)6/h2*7-10H,11-17H2,1-6H3;7-10H,11-16H2,1-6H3;7-10H,11-16H2,1-6H3;7-10H,11-15H2,1-6H3;7-10H,11-14H2,1-6H3;7-10H,11-14H2,1-6H3;7-10H,11-13H2,1-6H3;15H,4-14H2,1-3H3;7-10H,11-12H2,1-6H3
InChIKeyJSDNGUSGXICSBP-UHFFFAOYSA-N
XLogP43.39
TPSA255.69 Ų
H-Bond Donors
H-Bond Acceptors29
Rotatable Bonds74
Heavy Atoms215
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003014.58
LogP ≤ 543.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1029

Computed Properties (RDKit)

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

Analyze 1-tert-butyl-4-[2-(3,3-dimethylbutoxy)ethoxy]benzene;1-tert-butyl-4-[2-[2-(3,3-dimethylbutoxy)ethoxy]ethoxy]benzene;1-tert-butyl-4-[2-(2,2-dimethylpropoxy)ethoxy]benzene;1-tert-butyl-4-[2-[2-(2,2-dimethylpropoxy)ethoxy]ethoxy]benzene;bis(1-tert-butyl-4-[2-[2-[2-(2,2-dimethylpropoxy)ethoxy]ethoxy]ethoxy]benzene);1-tert-butyl-4-[2-[(2-methylpropan-2-yl)oxy]ethoxy]benzene;1-tert-butyl-4-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]benzene;1-tert-butyl-4-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethoxy]benzene;1-tert-butyl-4-(2-piperidin-1-ylethyl)piperidine with MolForge

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Related Compounds

1-[2-[2-(4-tert-butylphenoxy)ethoxy]ethyl]-4-methylpiperazine
CID 2270536
1-tert-butyl-4-[3-(2,2-dimethylpropoxy)propoxymethyl]benzene;1-tert-butyl-4-(2-piperidin-1-ylethyl)piperidine;2,2-dimethylpropane;3-(2,2-dimethylpropoxy)propoxymethylbenzene;bis(1-[2-[1-(2,2-dimethylpropyl)azetidin-3-yl]oxyethyl]piperidine);1-[[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxymethyl]piperidine
CID 158104120
1-[6-(4-tert-butylphenoxy)hexyl]pyrrolidine
CID 2232435
1-tert-butyl-4-[1-[2-[4-[6-[1-(4-tert-butylphenyl)piperidin-4-yl]-2,5,5-trimethylhexan-2-yl]phenoxy]ethyl]azetidin-3-yl]piperidine
CID 167158299
1-tert-butyl-4-[2-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethoxy]ethyl]piperazine
CID 171446821
1-tert-butyl-4-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethyl]piperazine
CID 135167668
1-tert-butyl-4-[(4-tert-butylpiperazin-1-yl)methyl]piperazine;1-tert-butyl-4-[(1-tert-butylpiperidin-4-yl)methyl]piperazine;1-tert-butyl-4-[2-(1-tert-butylpyrrolidin-3-yl)ethyl]piperazine;N-tert-butyl-4-(5,5-dimethylhexoxy)aniline;1-tert-butyl-4-(4,4-dimethylpentyl)piperazine;1-tert-butyl-4-(4,4-dimethylpentyl)piperidine;4-tert-butyl-1-(4,4-dimethylpentyl)piperidine;1-tert-butyl-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidine;N-tert-butyl-4-[3-[(2-methylpropan-2-yl)oxy]propoxy]aniline
CID 161282196
1-[2-(2-naphthalen-2-yloxyethoxy)ethyl]pyrrolidine
CID 2246231
1-[2-[4-(2-methylbutan-2-yl)phenoxy]ethyl]piperidine
CID 70865812
1-(1-tert-butylazetidin-3-yl)-4-(4-tert-butylphenyl)piperazine;1-(1-tert-butylazetidin-3-yl)-4-(4-tert-butylphenyl)piperidine;1-[(1-tert-butylazetidin-3-yl)methyl]-4-(4-tert-butylphenyl)piperazine;1-tert-butyl-4-[1-[2-(4-tert-butylphenoxy)ethyl]azetidin-3-yl]piperidine;1-tert-butyl-4-[3-(4-tert-butylphenoxy)propoxy]benzene;1-tert-butyl-3-[[3-(4-tert-butylphenyl)azetidin-1-yl]methyl]azetidine;1-tert-butyl-4-[2-[4-(4-tert-butylphenyl)piperazin-1-yl]ethyl]piperazine;1-tert-butyl-4-[3-[3-[(2-methylpropan-2-yl)oxy]propoxy]phenyl]benzene;1-[2-(4-tert-butylphenoxy)ethyl]-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;1-[2-(4-tert-butylphenoxy)ethyl]-4-[(2-methylpropan-2-yl)oxy]piperidine;1-(4-tert-butylphenyl)-4-(2,2-dimethylpropyl)piperidine;1-(4-tert-butylphenyl)-4-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethyl]piperazine;3-(4-tert-butylphenyl)-1-[3-[(2-methylpropan-2-yl)oxy]propyl]azetidine;1-(4-tert-butylphenyl)-4-[3-[(2-methylpropan-2-yl)oxy]propyl]piperazine
CID 158651668
1-tert-butyl-4-(3-tert-butylcyclohexyl)oxypiperidine;1-tert-butyl-4-[3-(4-tert-butylphenoxy)propoxy]benzene;1-tert-butyl-3-[[3-(4-tert-butylphenyl)azetidin-1-yl]methyl]azetidine;1-tert-butyl-4-[2-[4-(4-tert-butylphenyl)piperazin-1-yl]ethyl]piperazine;1-tert-butyl-4-[2-[3-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]phenoxy]ethoxy]benzene;1-tert-butyl-4-[3-[3-[(2-methylpropan-2-yl)oxy]propoxy]phenyl]benzene;1-tert-butyl-4-[4-[3-[(2-methylpropan-2-yl)oxy]propoxy]phenyl]benzene;1-(4-tert-butylphenyl)-4-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethyl]piperazine;3-(4-tert-butylphenyl)-1-[3-[(2-methylpropan-2-yl)oxy]propyl]azetidine;1-(4-tert-butylphenyl)-4-[3-[(2-methylpropan-2-yl)oxy]propyl]piperazine
CID 160651486
4-[2-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethoxy]ethoxy]benzoic acid
CID 58645066

Frequently Asked Questions

What is the IUPAC name of 1-tert-butyl-4-[2-(3,3-dimethylbutoxy)ethoxy]benzene;1-tert-butyl-4-[2-[2-(3,3-dimethylbutoxy)ethoxy]ethoxy]benzene;1-tert-butyl-4-[2-(2,2-dimethylpropoxy)ethoxy]benzene;1-tert-butyl-4-[2-[2-(2,2-dimethylpropoxy)ethoxy]ethoxy]benzene;bis(1-tert-butyl-4-[2-[2-[2-(2,2-dimethylpropoxy)ethoxy]ethoxy]ethoxy]benzene);1-tert-butyl-4-[2-[(2-methylpropan-2-yl)oxy]ethoxy]benzene;1-tert-butyl-4-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]benzene;1-tert-butyl-4-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethoxy]benzene;1-tert-butyl-4-(2-piperidin-1-ylethyl)piperidine?
The IUPAC name of 1-tert-butyl-4-[2-(3,3-dimethylbutoxy)ethoxy]benzene;1-tert-butyl-4-[2-[2-(3,3-dimethylbutoxy)ethoxy]ethoxy]benzene;1-tert-butyl-4-[2-(2,2-dimethylpropoxy)ethoxy]benzene;1-tert-butyl-4-[2-[2-(2,2-dimethylpropoxy)ethoxy]ethoxy]benzene;bis(1-tert-butyl-4-[2-[2-[2-(2,2-dimethylpropoxy)ethoxy]ethoxy]ethoxy]benzene);1-tert-butyl-4-[2-[(2-methylpropan-2-yl)oxy]ethoxy]benzene;1-tert-butyl-4-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]benzene;1-tert-butyl-4-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethoxy]benzene;1-tert-butyl-4-(2-piperidin-1-ylethyl)piperidine (CID 159007914) is 1-tert-butyl-4-[2-(3,3-dimethylbutoxy)ethoxy]benzene;1-tert-butyl-4-[2-[2-(3,3-dimethylbutoxy)ethoxy]ethoxy]benzene;1-tert-butyl-4-[2-(2,2-dimethylpropoxy)ethoxy]benzene;1-tert-butyl-4-[2-[2-(2,2-dimethylpropoxy)ethoxy]ethoxy]benzene;bis(1-tert-butyl-4-[2-[2-[2-(2,2-dimethylpropoxy)ethoxy]ethoxy]ethoxy]benzene);1-tert-butyl-4-[2-[(2-methylpropan-2-yl)oxy]ethoxy]benzene;1-tert-butyl-4-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]benzene;1-tert-butyl-4-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethoxy]benzene;1-tert-butyl-4-(2-piperidin-1-ylethyl)piperidine.
What is the SMILES notation for 1-tert-butyl-4-[2-(3,3-dimethylbutoxy)ethoxy]benzene;1-tert-butyl-4-[2-[2-(3,3-dimethylbutoxy)ethoxy]ethoxy]benzene;1-tert-butyl-4-[2-(2,2-dimethylpropoxy)ethoxy]benzene;1-tert-butyl-4-[2-[2-(2,2-dimethylpropoxy)ethoxy]ethoxy]benzene;bis(1-tert-butyl-4-[2-[2-[2-(2,2-dimethylpropoxy)ethoxy]ethoxy]ethoxy]benzene);1-tert-butyl-4-[2-[(2-methylpropan-2-yl)oxy]ethoxy]benzene;1-tert-butyl-4-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]benzene;1-tert-butyl-4-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethoxy]benzene;1-tert-butyl-4-(2-piperidin-1-ylethyl)piperidine?
The canonical SMILES for 1-tert-butyl-4-[2-(3,3-dimethylbutoxy)ethoxy]benzene;1-tert-butyl-4-[2-[2-(3,3-dimethylbutoxy)ethoxy]ethoxy]benzene;1-tert-butyl-4-[2-(2,2-dimethylpropoxy)ethoxy]benzene;1-tert-butyl-4-[2-[2-(2,2-dimethylpropoxy)ethoxy]ethoxy]benzene;bis(1-tert-butyl-4-[2-[2-[2-(2,2-dimethylpropoxy)ethoxy]ethoxy]ethoxy]benzene);1-tert-butyl-4-[2-[(2-methylpropan-2-yl)oxy]ethoxy]benzene;1-tert-butyl-4-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]benzene;1-tert-butyl-4-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethoxy]benzene;1-tert-butyl-4-(2-piperidin-1-ylethyl)piperidine is CC(C)(C)CCOCCOCCOc1ccc(C(C)(C)C)cc1.CC(C)(C)CCOCCOc1ccc(C(C)(C)C)cc1.CC(C)(C)COCCOCCOCCOc1ccc(C(C)(C)C)cc1.CC(C)(C)COCCOCCOCCOc1ccc(C(C)(C)C)cc1.CC(C)(C)COCCOCCOc1ccc(C(C)(C)C)cc1.CC(C)(C)COCCOc1ccc(C(C)(C)C)cc1.CC(C)(C)N1CCC(CCN2CCCCC2)CC1.CC(C)(C)OCCOCCOCCOc1ccc(C(C)(C)C)cc1.CC(C)(C)OCCOCCOc1ccc(C(C)(C)C)cc1.CC(C)(C)OCCOc1ccc(C(C)(C)C)cc1.
What is the InChIKey of 1-tert-butyl-4-[2-(3,3-dimethylbutoxy)ethoxy]benzene;1-tert-butyl-4-[2-[2-(3,3-dimethylbutoxy)ethoxy]ethoxy]benzene;1-tert-butyl-4-[2-(2,2-dimethylpropoxy)ethoxy]benzene;1-tert-butyl-4-[2-[2-(2,2-dimethylpropoxy)ethoxy]ethoxy]benzene;bis(1-tert-butyl-4-[2-[2-[2-(2,2-dimethylpropoxy)ethoxy]ethoxy]ethoxy]benzene);1-tert-butyl-4-[2-[(2-methylpropan-2-yl)oxy]ethoxy]benzene;1-tert-butyl-4-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]benzene;1-tert-butyl-4-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethoxy]benzene;1-tert-butyl-4-(2-piperidin-1-ylethyl)piperidine?
The InChIKey is JSDNGUSGXICSBP-UHFFFAOYSA-N. The full InChI is InChI=1S/2C21H36O4.C20H34O4.C20H34O3.C19H32O3.C18H30O3.C18H30O2.C17H28O2.C16H32N2.C16H26O2/c2*1-20(2,3)17-24-14-13-22-11-12-23-15-16-25-19-9-7-18(8-10-19)21(4,5)6;1-19(2,3)17-7-9-18(10-8-17)23-15-13-21-11-12-22-14-16-24-20(4,5)6;1-19(2,3)11-12-21-13-14-22-15-16-23-18-9-7-17(8-10-18)20(4,5)6;1-18(2,3)15-21-12-11-20-13-14-22-17-9-7-16(8-10-17)19(4,5)6;1-17(2,3)15-7-9-16(10-8-15)20-13-11-19-12-14-21-18(4,5)6;1-17(2,3)11-12-19-13-14-20-16-9-7-15(8-10-16)18(4,5)6;1-16(2,3)13-18-11-12-19-15-9-7-14(8-10-15)17(4,5)6;1-16(2,3)18-13-8-15(9-14-18)7-12-17-10-5-4-6-11-17;1-15(2,3)13-7-9-14(10-8-13)17-11-12-18-16(4,5)6/h2*7-10H,11-17H2,1-6H3;7-10H,11-16H2,1-6H3;7-10H,11-16H2,1-6H3;7-10H,11-15H2,1-6H3;7-10H,11-14H2,1-6H3;7-10H,11-14H2,1-6H3;7-10H,11-13H2,1-6H3;15H,4-14H2,1-3H3;7-10H,11-12H2,1-6H3.
What are the key properties of 1-tert-butyl-4-[2-(3,3-dimethylbutoxy)ethoxy]benzene;1-tert-butyl-4-[2-[2-(3,3-dimethylbutoxy)ethoxy]ethoxy]benzene;1-tert-butyl-4-[2-(2,2-dimethylpropoxy)ethoxy]benzene;1-tert-butyl-4-[2-[2-(2,2-dimethylpropoxy)ethoxy]ethoxy]benzene;bis(1-tert-butyl-4-[2-[2-[2-(2,2-dimethylpropoxy)ethoxy]ethoxy]ethoxy]benzene);1-tert-butyl-4-[2-[(2-methylpropan-2-yl)oxy]ethoxy]benzene;1-tert-butyl-4-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]benzene;1-tert-butyl-4-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethoxy]benzene;1-tert-butyl-4-(2-piperidin-1-ylethyl)piperidine?
1-tert-butyl-4-[2-(3,3-dimethylbutoxy)ethoxy]benzene;1-tert-butyl-4-[2-[2-(3,3-dimethylbutoxy)ethoxy]ethoxy]benzene;1-tert-butyl-4-[2-(2,2-dimethylpropoxy)ethoxy]benzene;1-tert-butyl-4-[2-[2-(2,2-dimethylpropoxy)ethoxy]ethoxy]benzene;bis(1-tert-butyl-4-[2-[2-[2-(2,2-dimethylpropoxy)ethoxy]ethoxy]ethoxy]benzene);1-tert-butyl-4-[2-[(2-methylpropan-2-yl)oxy]ethoxy]benzene;1-tert-butyl-4-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]benzene;1-tert-butyl-4-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethoxy]benzene;1-tert-butyl-4-(2-piperidin-1-ylethyl)piperidine has a molecular weight of 3014.58 g/mol, XLogP of 43.39, 74 rotatable bonds, 0 hydrogen bond donors, and 29 hydrogen bond acceptors.
Where does this data come from?
All data for 1-tert-butyl-4-[2-(3,3-dimethylbutoxy)ethoxy]benzene;1-tert-butyl-4-[2-[2-(3,3-dimethylbutoxy)ethoxy]ethoxy]benzene;1-tert-butyl-4-[2-(2,2-dimethylpropoxy)ethoxy]benzene;1-tert-butyl-4-[2-[2-(2,2-dimethylpropoxy)ethoxy]ethoxy]benzene;bis(1-tert-butyl-4-[2-[2-[2-(2,2-dimethylpropoxy)ethoxy]ethoxy]ethoxy]benzene);1-tert-butyl-4-[2-[(2-methylpropan-2-yl)oxy]ethoxy]benzene;1-tert-butyl-4-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]benzene;1-tert-butyl-4-[2-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]ethoxy]benzene;1-tert-butyl-4-(2-piperidin-1-ylethyl)piperidine is sourced from PubChem (CID 159007914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).