1-tert-butyl-6-phenyldibenzofuran;1-tert-butyl-7-phenyldibenzofuran;2-tert-butyl-6-phenyldibenzofuran;2-tert-butyl-7-phenyldibenzofuran;3-tert-butyl-7-phenyldibenzofuran;6-tert-butyl-2-phenyldibenzofuran;6-tert-butyl-3-phenyldibenzofuran

C154H140O7 — CID 165019061

IUPAC1-tert-butyl-6-phenyldibenzofuran;1-tert-butyl-7-phenyldibenzofuran;2-tert-butyl-6-phenyldibenzofuran;2-tert-butyl-7-phenyldibenzofuran;3-tert-butyl-7-phenyldibenzofuran;6-tert-butyl-2-phenyldibenzofuran;6-tert-butyl-3-phenyldibenzofuran
SMILESCC(C)(C)c1ccc2c(c1)oc1cc(-c3ccccc3)ccc12.CC(C)(C)c1ccc2oc3c(-c4ccccc4)cccc3c2c1.CC(C)(C)c1ccc2oc3cc(-c4ccccc4)ccc3c2c1.CC(C)(C)c1cccc2c1oc1cc(-c3ccccc3)ccc12.CC(C)(C)c1cccc2c1oc1ccc(-c3ccccc3)cc12.CC(C)(C)c1cccc2oc3c(-c4ccccc4)cccc3c12.CC(C)(C)c1cccc2oc3cc(-c4ccccc4)ccc3c12
InChIInChI=1S/7C22H20O/c1-22(2,3)18-13-8-14-19-20(18)17-12-7-11-16(21(17)23-19)15-9-5-4-6-10-15;1-22(2,3)16-12-13-20-19(14-16)18-11-7-10-17(21(18)23-20)15-8-5-4-6-9-15;1-22(2,3)18-10-7-11-19-21(18)17-13-12-16(14-20(17)23-19)15-8-5-4-6-9-15;1-22(2,3)19-11-7-10-18-17-13-12-16(14-20(17)23-21(18)19)15-8-5-4-6-9-15;1-22(2,3)19-11-7-10-17-18-14-16(15-8-5-4-6-9-15)12-13-20(18)23-21(17)19;1-22(2,3)17-10-12-20-19(14-17)18-11-9-16(13-21(18)23-20)15-7-5-4-6-8-15;1-22(2,3)17-10-12-19-18-11-9-16(15-7-5-4-6-8-15)13-20(18)23-21(19)14-17/h7*4-14H,1-3H3
InChIKeyKWKFZNAKPLOQLP-UHFFFAOYSA-N
MW2102.81 g/mol
LogP45.85
Rot. Bonds7

About 1-tert-butyl-6-phenyldibenzofuran;1-tert-butyl-7-phenyldibenzofuran;2-tert-butyl-6-phenyldibenzofuran;2-tert-butyl-7-phenyldibenzofuran;3-tert-butyl-7-phenyldibenzofuran;6-tert-butyl-2-phenyldibenzofuran;6-tert-butyl-3-phenyldibenzofuran

1-tert-butyl-6-phenyldibenzofuran;1-tert-butyl-7-phenyldibenzofuran;2-tert-butyl-6-phenyldibenzofuran;2-tert-butyl-7-phenyldibenzofuran;3-tert-butyl-7-phenyldibenzofuran;6-tert-butyl-2-phenyldibenzofuran;6-tert-butyl-3-phenyldibenzofuran (PubChem CID 165019061) has the molecular formula C154H140O7 and a molecular weight of 2102.81 g/mol. Its IUPAC name is 1-tert-butyl-6-phenyldibenzofuran;1-tert-butyl-7-phenyldibenzofuran;2-tert-butyl-6-phenyldibenzofuran;2-tert-butyl-7-phenyldibenzofuran;3-tert-butyl-7-phenyldibenzofuran;6-tert-butyl-2-phenyldibenzofuran;6-tert-butyl-3-phenyldibenzofuran.

Molecular Properties

Compound Name1-tert-butyl-6-phenyldibenzofuran;1-tert-butyl-7-phenyldibenzofuran;2-tert-butyl-6-phenyldibenzofuran;2-tert-butyl-7-phenyldibenzofuran;3-tert-butyl-7-phenyldibenzofuran;6-tert-butyl-2-phenyldibenzofuran;6-tert-butyl-3-phenyldibenzofuran
PubChem CID165019061
Molecular FormulaC154H140O7
Molecular Weight2102.81 g/mol
Exact Mass2101.06
IUPAC Name1-tert-butyl-6-phenyldibenzofuran;1-tert-butyl-7-phenyldibenzofuran;2-tert-butyl-6-phenyldibenzofuran;2-tert-butyl-7-phenyldibenzofuran;3-tert-butyl-7-phenyldibenzofuran;6-tert-butyl-2-phenyldibenzofuran;6-tert-butyl-3-phenyldibenzofuran
SMILESCC(C)(C)c1ccc2c(c1)oc1cc(-c3ccccc3)ccc12.CC(C)(C)c1ccc2oc3c(-c4ccccc4)cccc3c2c1.CC(C)(C)c1ccc2oc3cc(-c4ccccc4)ccc3c2c1.CC(C)(C)c1cccc2c1oc1cc(-c3ccccc3)ccc12.CC(C)(C)c1cccc2c1oc1ccc(-c3ccccc3)cc12.CC(C)(C)c1cccc2oc3c(-c4ccccc4)cccc3c12.CC(C)(C)c1cccc2oc3cc(-c4ccccc4)ccc3c12
InChIInChI=1S/7C22H20O/c1-22(2,3)18-13-8-14-19-20(18)17-12-7-11-16(21(17)23-19)15-9-5-4-6-10-15;1-22(2,3)16-12-13-20-19(14-16)18-11-7-10-17(21(18)23-20)15-8-5-4-6-9-15;1-22(2,3)18-10-7-11-19-21(18)17-13-12-16(14-20(17)23-19)15-8-5-4-6-9-15;1-22(2,3)19-11-7-10-18-17-13-12-16(14-20(17)23-21(18)19)15-8-5-4-6-9-15;1-22(2,3)19-11-7-10-17-18-14-16(15-8-5-4-6-9-15)12-13-20(18)23-21(17)19;1-22(2,3)17-10-12-20-19(14-17)18-11-9-16(13-21(18)23-20)15-7-5-4-6-8-15;1-22(2,3)17-10-12-19-18-11-9-16(15-7-5-4-6-8-15)13-20(18)23-21(19)14-17/h7*4-14H,1-3H3
InChIKeyKWKFZNAKPLOQLP-UHFFFAOYSA-N
XLogP45.85
TPSA91.98 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms161
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002102.81
LogP ≤ 545.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 1-tert-butyl-6-phenyldibenzofuran;1-tert-butyl-7-phenyldibenzofuran;2-tert-butyl-6-phenyldibenzofuran;2-tert-butyl-7-phenyldibenzofuran;3-tert-butyl-7-phenyldibenzofuran;6-tert-butyl-2-phenyldibenzofuran;6-tert-butyl-3-phenyldibenzofuran with MolForge

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Related Compounds

1-tert-butyl-2,4-diphenylbenzene;2-(3-tert-butylphenyl)dibenzofuran;2-(4-tert-butylphenyl)dibenzofuran;3-(3-tert-butylphenyl)dibenzofuran;3-(4-tert-butylphenyl)dibenzofuran;4-(4-tert-butylphenyl)dibenzofuran
CID 160962612
2-tert-butyl-7-phenyldibenzofuran;7-tert-butyl-1-phenyldibenzofuran;1-phenyl-8-propan-2-yldibenzofuran;2-phenyl-8-propan-2-yldibenzofuran;6-phenyl-1-propan-2-yldibenzofuran;6-phenyl-2-propan-2-yldibenzofuran
CID 165014569
7-tert-butyl-1-phenyldibenzofuran;1-phenyl-8-propan-2-yldibenzofuran;2-phenyl-8-propan-2-yldibenzofuran;6-phenyl-1-propan-2-yldibenzofuran;6-phenyl-2-propan-2-yldibenzofuran;7-phenyl-2-propan-2-yldibenzofuran
CID 164972910
tert-butylbenzene;1-tert-butyldibenzofuran;2-tert-butyldibenzofuran;3-tert-butyldibenzofuran;4-tert-butyldibenzofuran;1-tert-butyldibenzothiophene;2-tert-butyldibenzothiophene;3-tert-butyldibenzothiophene;4-tert-butyldibenzothiophene;1-tert-butyl-2-phenylbenzene;1-tert-butyl-3-phenylbenzene;1-tert-butyl-4-phenylbenzene
CID 159707731
1-(4-triphenylen-2-ylphenyl)dibenzofuran;2-(4-triphenylen-2-ylphenyl)dibenzofuran;3-(3-triphenylen-2-ylphenyl)dibenzofuran;3-(4-triphenylen-2-ylphenyl)dibenzofuran;4-(4-triphenylen-2-ylphenyl)dibenzofuran
CID 160897706
2-tert-butyl-8-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)dibenzofuran;6-tert-butyl-2-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)dibenzofuran;methane;1-[1,2,3,4,5,6,7,8-octadeuterio-10-(2,3,4,5,6-pentadeuteriophenyl)anthracen-9-yl]dibenzofuran;2-[4-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)naphthalen-1-yl]dibenzofuran;2-[6-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)naphthalen-2-yl]dibenzofuran;2-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)-6-phenyldibenzofuran;2-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)-8-phenyldibenzofuran;2-[4-[4-(1,2,3,4,5,6,7,8-octadeuterio-10-phenylanthracen-9-yl)phenyl]phenyl]dibenzofuran
CID 158198714
4-(10-tert-butyl-7-dibenzofuran-4-yltriphenylen-2-yl)dibenzofuran
CID 144568505
1-tert-butyl-2-(6-tert-butyldibenzofuran-3-yl)dibenzofuran
CID 138707220
6-tert-butyl-[1]benzofuro[2,3-b]pyridine;4-tert-butyl-6-phenyldibenzofuran;6-tert-butyl-1-phenyldibenzofuran;6-tert-butyl-2-phenyldibenzofuran;6-tert-butyl-3-phenyldibenzofuran;4-tert-butyl-6-phenyldibenzothiophene;6-tert-butyl-1-phenyldibenzothiophene;6-tert-butyl-2-phenyldibenzothiophene;6-tert-butyl-3-phenyldibenzothiophene;methane
CID 158591449
9-[4-(4-dibenzofuran-2-yl-6-dibenzofuran-3-yl-1,3,5-triazin-2-yl)-2,6-diphenylphenyl]-3-phenylcarbazole;9-[4-(4-dibenzofuran-3-yl-6-dibenzofuran-4-yl-1,3,5-triazin-2-yl)-2,6-diphenylphenyl]-3-phenylcarbazole;9-[4-[4-dibenzofuran-1-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-3,6-diphenylcarbazole;9-[4-[4-dibenzofuran-1-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]-3-phenylcarbazole;9-[4-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)-2,6-diphenylphenyl]-3,6-diphenylcarbazole;9-[4-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)-2,6-diphenylphenyl]-3-phenylcarbazole;3,6-ditert-butyl-9-[4-[4-dibenzofuran-1-yl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]-2,6-diphenylphenyl]carbazole;3,6-ditert-butyl-9-[4-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)-2,6-diphenylphenyl]carbazole
CID 159376231
7-phenyl-N-[4-(6-phenyldibenzofuran-2-yl)phenyl]-N-(4-phenylphenyl)dibenzofuran-3-amine
CID 168805484
4-N-(4-dibenzofuran-2-ylphenyl)-4-N-(4-dibenzofuran-4-ylphenyl)-1-N,1-N-bis(4-phenylphenyl)benzene-1,4-diamine
CID 58510699

Frequently Asked Questions

What is the IUPAC name of 1-tert-butyl-6-phenyldibenzofuran;1-tert-butyl-7-phenyldibenzofuran;2-tert-butyl-6-phenyldibenzofuran;2-tert-butyl-7-phenyldibenzofuran;3-tert-butyl-7-phenyldibenzofuran;6-tert-butyl-2-phenyldibenzofuran;6-tert-butyl-3-phenyldibenzofuran?
The IUPAC name of 1-tert-butyl-6-phenyldibenzofuran;1-tert-butyl-7-phenyldibenzofuran;2-tert-butyl-6-phenyldibenzofuran;2-tert-butyl-7-phenyldibenzofuran;3-tert-butyl-7-phenyldibenzofuran;6-tert-butyl-2-phenyldibenzofuran;6-tert-butyl-3-phenyldibenzofuran (CID 165019061) is 1-tert-butyl-6-phenyldibenzofuran;1-tert-butyl-7-phenyldibenzofuran;2-tert-butyl-6-phenyldibenzofuran;2-tert-butyl-7-phenyldibenzofuran;3-tert-butyl-7-phenyldibenzofuran;6-tert-butyl-2-phenyldibenzofuran;6-tert-butyl-3-phenyldibenzofuran.
What is the SMILES notation for 1-tert-butyl-6-phenyldibenzofuran;1-tert-butyl-7-phenyldibenzofuran;2-tert-butyl-6-phenyldibenzofuran;2-tert-butyl-7-phenyldibenzofuran;3-tert-butyl-7-phenyldibenzofuran;6-tert-butyl-2-phenyldibenzofuran;6-tert-butyl-3-phenyldibenzofuran?
The canonical SMILES for 1-tert-butyl-6-phenyldibenzofuran;1-tert-butyl-7-phenyldibenzofuran;2-tert-butyl-6-phenyldibenzofuran;2-tert-butyl-7-phenyldibenzofuran;3-tert-butyl-7-phenyldibenzofuran;6-tert-butyl-2-phenyldibenzofuran;6-tert-butyl-3-phenyldibenzofuran is CC(C)(C)c1ccc2c(c1)oc1cc(-c3ccccc3)ccc12.CC(C)(C)c1ccc2oc3c(-c4ccccc4)cccc3c2c1.CC(C)(C)c1ccc2oc3cc(-c4ccccc4)ccc3c2c1.CC(C)(C)c1cccc2c1oc1cc(-c3ccccc3)ccc12.CC(C)(C)c1cccc2c1oc1ccc(-c3ccccc3)cc12.CC(C)(C)c1cccc2oc3c(-c4ccccc4)cccc3c12.CC(C)(C)c1cccc2oc3cc(-c4ccccc4)ccc3c12.
What is the InChIKey of 1-tert-butyl-6-phenyldibenzofuran;1-tert-butyl-7-phenyldibenzofuran;2-tert-butyl-6-phenyldibenzofuran;2-tert-butyl-7-phenyldibenzofuran;3-tert-butyl-7-phenyldibenzofuran;6-tert-butyl-2-phenyldibenzofuran;6-tert-butyl-3-phenyldibenzofuran?
The InChIKey is KWKFZNAKPLOQLP-UHFFFAOYSA-N. The full InChI is InChI=1S/7C22H20O/c1-22(2,3)18-13-8-14-19-20(18)17-12-7-11-16(21(17)23-19)15-9-5-4-6-10-15;1-22(2,3)16-12-13-20-19(14-16)18-11-7-10-17(21(18)23-20)15-8-5-4-6-9-15;1-22(2,3)18-10-7-11-19-21(18)17-13-12-16(14-20(17)23-19)15-8-5-4-6-9-15;1-22(2,3)19-11-7-10-18-17-13-12-16(14-20(17)23-21(18)19)15-8-5-4-6-9-15;1-22(2,3)19-11-7-10-17-18-14-16(15-8-5-4-6-9-15)12-13-20(18)23-21(17)19;1-22(2,3)17-10-12-20-19(14-17)18-11-9-16(13-21(18)23-20)15-7-5-4-6-8-15;1-22(2,3)17-10-12-19-18-11-9-16(15-7-5-4-6-8-15)13-20(18)23-21(19)14-17/h7*4-14H,1-3H3.
What are the key properties of 1-tert-butyl-6-phenyldibenzofuran;1-tert-butyl-7-phenyldibenzofuran;2-tert-butyl-6-phenyldibenzofuran;2-tert-butyl-7-phenyldibenzofuran;3-tert-butyl-7-phenyldibenzofuran;6-tert-butyl-2-phenyldibenzofuran;6-tert-butyl-3-phenyldibenzofuran?
1-tert-butyl-6-phenyldibenzofuran;1-tert-butyl-7-phenyldibenzofuran;2-tert-butyl-6-phenyldibenzofuran;2-tert-butyl-7-phenyldibenzofuran;3-tert-butyl-7-phenyldibenzofuran;6-tert-butyl-2-phenyldibenzofuran;6-tert-butyl-3-phenyldibenzofuran has a molecular weight of 2102.81 g/mol, XLogP of 45.85, 7 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-tert-butyl-6-phenyldibenzofuran;1-tert-butyl-7-phenyldibenzofuran;2-tert-butyl-6-phenyldibenzofuran;2-tert-butyl-7-phenyldibenzofuran;3-tert-butyl-7-phenyldibenzofuran;6-tert-butyl-2-phenyldibenzofuran;6-tert-butyl-3-phenyldibenzofuran is sourced from PubChem (CID 165019061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).