2-dibenzofuran-1-yl-9-spiro[adamantane-2,9'-fluorene]-2'-ylcarbazole;bis(2-dibenzofuran-2-yl-9-spiro[adamantane-2,9'-fluorene]-2'-ylcarbazole);3-dibenzofuran-3-yl-9-spiro[adamantane-2,9'-fluorene]-2'-ylcarbazole

C184H140N4O4 — CID 165104436

IUPAC2-dibenzofuran-1-yl-9-spiro[adamantane-2,9'-fluorene]-2'-ylcarbazole;bis(2-dibenzofuran-2-yl-9-spiro[adamantane-2,9'-fluorene]-2'-ylcarbazole);3-dibenzofuran-3-yl-9-spiro[adamantane-2,9'-fluorene]-2'-ylcarbazole
SMILESc1ccc2c(c1)-c1ccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)oc5ccccc56)ccc43)cc1C21C2CC3CC(C2)CC1C3.c1ccc2c(c1)-c1ccc(-n3c4ccccc4c4ccc(-c5ccc6oc7ccccc7c6c5)cc43)cc1C21C2CC3CC(C2)CC1C3.c1ccc2c(c1)-c1ccc(-n3c4ccccc4c4ccc(-c5ccc6oc7ccccc7c6c5)cc43)cc1C21C2CC3CC(C2)CC1C3.c1ccc2c(c1)-c1ccc(-n3c4ccccc4c4ccc(-c5cccc6oc7ccccc7c56)cc43)cc1C21C2CC3CC(C2)CC1C3
InChIInChI=1S/4C46H35NO/c1-4-12-39-34(8-1)35-19-17-32(26-40(35)46(39)30-21-27-20-28(23-30)24-31(46)22-27)47-41-13-5-2-9-36(41)37-18-16-29(25-42(37)47)33-11-7-15-44-45(33)38-10-3-6-14-43(38)48-44;2*1-4-10-40-34(7-1)35-17-15-33(26-41(35)46(40)31-20-27-19-28(22-31)23-32(46)21-27)47-42-11-5-2-8-36(42)37-16-13-30(25-43(37)47)29-14-18-45-39(24-29)38-9-3-6-12-44(38)48-45;1-4-10-40-34(7-1)35-17-15-33(26-41(35)46(40)31-20-27-19-28(22-31)23-32(46)21-27)47-42-11-5-2-8-36(42)39-24-29(14-18-43(39)47)30-13-16-38-37-9-3-6-12-44(37)48-45(38)25-30/h1-19,25-28,30-31H,20-24H2;3*1-18,24-28,31-32H,19-23H2
InChIKeyYWVFXHMJWCBYAJ-UHFFFAOYSA-N
MW2471.17 g/mol
LogP48.29
Rot. Bonds8

About 2-dibenzofuran-1-yl-9-spiro[adamantane-2,9'-fluorene]-2'-ylcarbazole;bis(2-dibenzofuran-2-yl-9-spiro[adamantane-2,9'-fluorene]-2'-ylcarbazole);3-dibenzofuran-3-yl-9-spiro[adamantane-2,9'-fluorene]-2'-ylcarbazole

2-dibenzofuran-1-yl-9-spiro[adamantane-2,9'-fluorene]-2'-ylcarbazole;bis(2-dibenzofuran-2-yl-9-spiro[adamantane-2,9'-fluorene]-2'-ylcarbazole);3-dibenzofuran-3-yl-9-spiro[adamantane-2,9'-fluorene]-2'-ylcarbazole (PubChem CID 165104436) has the molecular formula C184H140N4O4 and a molecular weight of 2471.17 g/mol. Its IUPAC name is 2-dibenzofuran-1-yl-9-spiro[adamantane-2,9'-fluorene]-2'-ylcarbazole;bis(2-dibenzofuran-2-yl-9-spiro[adamantane-2,9'-fluorene]-2'-ylcarbazole);3-dibenzofuran-3-yl-9-spiro[adamantane-2,9'-fluorene]-2'-ylcarbazole.

Molecular Properties

Compound Name2-dibenzofuran-1-yl-9-spiro[adamantane-2,9'-fluorene]-2'-ylcarbazole;bis(2-dibenzofuran-2-yl-9-spiro[adamantane-2,9'-fluorene]-2'-ylcarbazole);3-dibenzofuran-3-yl-9-spiro[adamantane-2,9'-fluorene]-2'-ylcarbazole
PubChem CID165104436
Molecular FormulaC184H140N4O4
Molecular Weight2471.17 g/mol
Exact Mass2469.09
IUPAC Name2-dibenzofuran-1-yl-9-spiro[adamantane-2,9'-fluorene]-2'-ylcarbazole;bis(2-dibenzofuran-2-yl-9-spiro[adamantane-2,9'-fluorene]-2'-ylcarbazole);3-dibenzofuran-3-yl-9-spiro[adamantane-2,9'-fluorene]-2'-ylcarbazole
SMILESc1ccc2c(c1)-c1ccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)oc5ccccc56)ccc43)cc1C21C2CC3CC(C2)CC1C3.c1ccc2c(c1)-c1ccc(-n3c4ccccc4c4ccc(-c5ccc6oc7ccccc7c6c5)cc43)cc1C21C2CC3CC(C2)CC1C3.c1ccc2c(c1)-c1ccc(-n3c4ccccc4c4ccc(-c5ccc6oc7ccccc7c6c5)cc43)cc1C21C2CC3CC(C2)CC1C3.c1ccc2c(c1)-c1ccc(-n3c4ccccc4c4ccc(-c5cccc6oc7ccccc7c56)cc43)cc1C21C2CC3CC(C2)CC1C3
InChIInChI=1S/4C46H35NO/c1-4-12-39-34(8-1)35-19-17-32(26-40(35)46(39)30-21-27-20-28(23-30)24-31(46)22-27)47-41-13-5-2-9-36(41)37-18-16-29(25-42(37)47)33-11-7-15-44-45(33)38-10-3-6-14-43(38)48-44;2*1-4-10-40-34(7-1)35-17-15-33(26-41(35)46(40)31-20-27-19-28(22-31)23-32(46)21-27)47-42-11-5-2-8-36(42)37-16-13-30(25-43(37)47)29-14-18-45-39(24-29)38-9-3-6-12-44(38)48-45;1-4-10-40-34(7-1)35-17-15-33(26-41(35)46(40)31-20-27-19-28(22-31)23-32(46)21-27)47-42-11-5-2-8-36(42)39-24-29(14-18-43(39)47)30-13-16-38-37-9-3-6-12-44(37)48-45(38)25-30/h1-19,25-28,30-31H,20-24H2;3*1-18,24-28,31-32H,19-23H2
InChIKeyYWVFXHMJWCBYAJ-UHFFFAOYSA-N
XLogP48.29
TPSA72.28 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds8
Heavy Atoms192
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002471.17
LogP ≤ 548.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze 2-dibenzofuran-1-yl-9-spiro[adamantane-2,9'-fluorene]-2'-ylcarbazole;bis(2-dibenzofuran-2-yl-9-spiro[adamantane-2,9'-fluorene]-2'-ylcarbazole);3-dibenzofuran-3-yl-9-spiro[adamantane-2,9'-fluorene]-2'-ylcarbazole with MolForge

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Related Compounds

1-dibenzofuran-1-yl-9-spiro[adamantane-2,9'-fluorene]-2'-ylcarbazole;1-dibenzofuran-2-yl-9-spiro[adamantane-2,9'-fluorene]-2'-ylcarbazole;1-dibenzofuran-3-yl-9-spiro[adamantane-2,9'-fluorene]-2'-ylcarbazole;4-dibenzofuran-1-yl-9-spiro[adamantane-2,9'-fluorene]-3'-ylcarbazole
CID 165073836
3-dibenzofuran-4-yl-9-spiro[adamantane-2,9'-fluorene]-2'-ylcarbazole
CID 164810057
2-(9-dibenzofuran-3-ylcarbazol-2-yl)-9-[6-(4-spiro[adamantane-2,9'-fluorene]-2'-ylphenyl)naphthalen-2-yl]carbazole;2-[2-[9-(4-naphthalen-2-ylphenyl)carbazol-2-yl]carbazol-9-yl]-9-phenyl-7-spiro[adamantane-2,9'-fluorene]-2'-ylcarbazole
CID 165110729
3-[9-(3-phenylphenyl)carbazol-2-yl]-9-spiro[adamantane-2,9'-fluorene]-2'-ylcarbazole;3-[9-(3-phenylphenyl)carbazol-4-yl]-9-spiro[adamantane-2,9'-fluorene]-2'-ylcarbazole;4-[9-(3-phenylphenyl)carbazol-2-yl]-9-spiro[adamantane-2,9'-fluorene]-2'-ylcarbazole
CID 164952773
3-[9-(3-phenylphenyl)carbazol-2-yl]-9-spiro[adamantane-2,9'-fluorene]-2'-ylcarbazole
CID 164810005
3-[9-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)carbazol-3-yl]-9-spiro[adamantane-2,9'-fluorene]-2'-ylcarbazole;3-[9-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)carbazol-3-yl]-9-spiro[adamantane-2,9'-fluorene]-2'-ylcarbazole;3-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]-9-spiro[adamantane-2,9'-fluorene]-2'-ylcarbazole
CID 165034164
1-dibenzofuran-1-yl-9-spiro[adamantane-2,9'-fluorene]-2'-ylcarbazole
CID 164809970
2-(9-dibenzofuran-2-ylcarbazol-2-yl)-9-(9,9-dimethyl-6-spiro[adamantane-2,9'-fluorene]-2'-ylfluoren-3-yl)carbazole;9-phenanthren-2-yl-2-[9-[4-(2-spiro[adamantane-2,9'-fluorene]-2'-ylcarbazol-9-yl)phenyl]carbazol-2-yl]carbazole
CID 165043063
2-(4-dibenzofuran-2-ylphenyl)-9-(3-phenylphenyl)carbazole;3-dibenzofuran-1-yl-9-[4-(4-phenylphenyl)phenyl]carbazole;3-[9-(9,9-dimethylfluoren-2-yl)carbazol-3-yl]-9-(3-phenylphenyl)carbazole
CID 159534848
3-dibenzofuran-1-yl-6-(9-naphthalen-2-ylcarbazol-3-yl)-9-phenylcarbazole;3-dibenzofuran-2-yl-6-(9-naphthalen-2-ylcarbazol-3-yl)-9-phenylcarbazole;3-dibenzofuran-3-yl-6-(9-naphthalen-2-ylcarbazol-3-yl)-9-phenylcarbazole
CID 163841517
2-(4-dibenzofuran-3-yl-6-spiro[adamantane-2,9'-fluorene]-3'-yl-1,3,5-triazin-2-yl)-9-phenylcarbazole
CID 156561488
9-(4-phenylphenyl)-2-spiro[adamantane-2,9'-fluorene]-2'-ylcarbazole
CID 156577007

Frequently Asked Questions

What is the IUPAC name of 2-dibenzofuran-1-yl-9-spiro[adamantane-2,9'-fluorene]-2'-ylcarbazole;bis(2-dibenzofuran-2-yl-9-spiro[adamantane-2,9'-fluorene]-2'-ylcarbazole);3-dibenzofuran-3-yl-9-spiro[adamantane-2,9'-fluorene]-2'-ylcarbazole?
The IUPAC name of 2-dibenzofuran-1-yl-9-spiro[adamantane-2,9'-fluorene]-2'-ylcarbazole;bis(2-dibenzofuran-2-yl-9-spiro[adamantane-2,9'-fluorene]-2'-ylcarbazole);3-dibenzofuran-3-yl-9-spiro[adamantane-2,9'-fluorene]-2'-ylcarbazole (CID 165104436) is 2-dibenzofuran-1-yl-9-spiro[adamantane-2,9'-fluorene]-2'-ylcarbazole;bis(2-dibenzofuran-2-yl-9-spiro[adamantane-2,9'-fluorene]-2'-ylcarbazole);3-dibenzofuran-3-yl-9-spiro[adamantane-2,9'-fluorene]-2'-ylcarbazole.
What is the SMILES notation for 2-dibenzofuran-1-yl-9-spiro[adamantane-2,9'-fluorene]-2'-ylcarbazole;bis(2-dibenzofuran-2-yl-9-spiro[adamantane-2,9'-fluorene]-2'-ylcarbazole);3-dibenzofuran-3-yl-9-spiro[adamantane-2,9'-fluorene]-2'-ylcarbazole?
The canonical SMILES for 2-dibenzofuran-1-yl-9-spiro[adamantane-2,9'-fluorene]-2'-ylcarbazole;bis(2-dibenzofuran-2-yl-9-spiro[adamantane-2,9'-fluorene]-2'-ylcarbazole);3-dibenzofuran-3-yl-9-spiro[adamantane-2,9'-fluorene]-2'-ylcarbazole is c1ccc2c(c1)-c1ccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)oc5ccccc56)ccc43)cc1C21C2CC3CC(C2)CC1C3.c1ccc2c(c1)-c1ccc(-n3c4ccccc4c4ccc(-c5ccc6oc7ccccc7c6c5)cc43)cc1C21C2CC3CC(C2)CC1C3.c1ccc2c(c1)-c1ccc(-n3c4ccccc4c4ccc(-c5ccc6oc7ccccc7c6c5)cc43)cc1C21C2CC3CC(C2)CC1C3.c1ccc2c(c1)-c1ccc(-n3c4ccccc4c4ccc(-c5cccc6oc7ccccc7c56)cc43)cc1C21C2CC3CC(C2)CC1C3.
What is the InChIKey of 2-dibenzofuran-1-yl-9-spiro[adamantane-2,9'-fluorene]-2'-ylcarbazole;bis(2-dibenzofuran-2-yl-9-spiro[adamantane-2,9'-fluorene]-2'-ylcarbazole);3-dibenzofuran-3-yl-9-spiro[adamantane-2,9'-fluorene]-2'-ylcarbazole?
The InChIKey is YWVFXHMJWCBYAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/4C46H35NO/c1-4-12-39-34(8-1)35-19-17-32(26-40(35)46(39)30-21-27-20-28(23-30)24-31(46)22-27)47-41-13-5-2-9-36(41)37-18-16-29(25-42(37)47)33-11-7-15-44-45(33)38-10-3-6-14-43(38)48-44;2*1-4-10-40-34(7-1)35-17-15-33(26-41(35)46(40)31-20-27-19-28(22-31)23-32(46)21-27)47-42-11-5-2-8-36(42)37-16-13-30(25-43(37)47)29-14-18-45-39(24-29)38-9-3-6-12-44(38)48-45;1-4-10-40-34(7-1)35-17-15-33(26-41(35)46(40)31-20-27-19-28(22-31)23-32(46)21-27)47-42-11-5-2-8-36(42)39-24-29(14-18-43(39)47)30-13-16-38-37-9-3-6-12-44(37)48-45(38)25-30/h1-19,25-28,30-31H,20-24H2;3*1-18,24-28,31-32H,19-23H2.
What are the key properties of 2-dibenzofuran-1-yl-9-spiro[adamantane-2,9'-fluorene]-2'-ylcarbazole;bis(2-dibenzofuran-2-yl-9-spiro[adamantane-2,9'-fluorene]-2'-ylcarbazole);3-dibenzofuran-3-yl-9-spiro[adamantane-2,9'-fluorene]-2'-ylcarbazole?
2-dibenzofuran-1-yl-9-spiro[adamantane-2,9'-fluorene]-2'-ylcarbazole;bis(2-dibenzofuran-2-yl-9-spiro[adamantane-2,9'-fluorene]-2'-ylcarbazole);3-dibenzofuran-3-yl-9-spiro[adamantane-2,9'-fluorene]-2'-ylcarbazole has a molecular weight of 2471.17 g/mol, XLogP of 48.29, 8 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-dibenzofuran-1-yl-9-spiro[adamantane-2,9'-fluorene]-2'-ylcarbazole;bis(2-dibenzofuran-2-yl-9-spiro[adamantane-2,9'-fluorene]-2'-ylcarbazole);3-dibenzofuran-3-yl-9-spiro[adamantane-2,9'-fluorene]-2'-ylcarbazole is sourced from PubChem (CID 165104436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).