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

C135H90N4O2 — CID 159534848

IUPAC2-(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
SMILESCC1(C)c2ccccc2-c2ccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5cccc(-c6ccccc6)c5)ccc43)cc21.c1ccc(-c2ccc(-c3ccc(-n4c5ccccc5c5cc(-c6cccc7oc8ccccc8c67)ccc54)cc3)cc2)cc1.c1ccc(-c2cccc(-n3c4ccccc4c4ccc(-c5ccc(-c6ccc7oc8ccccc8c7c6)cc5)cc43)c2)cc1
InChIInChI=1S/C51H36N2.2C42H27NO/c1-51(2)45-20-9-6-17-39(45)40-26-25-38(32-46(40)51)53-48-22-11-8-19-42(48)44-31-36(24-28-50(44)53)35-23-27-49-43(30-35)41-18-7-10-21-47(41)52(49)37-16-12-15-34(29-37)33-13-4-3-5-14-33;1-2-9-28(10-3-1)31-11-8-12-34(25-31)43-39-15-6-4-13-35(39)36-23-21-33(27-40(36)43)30-19-17-29(18-20-30)32-22-24-42-38(26-32)37-14-5-7-16-41(37)44-42;1-2-9-28(10-3-1)29-17-19-30(20-18-29)31-21-24-33(25-22-31)43-38-14-6-4-11-35(38)37-27-32(23-26-39(37)43)34-13-8-16-41-42(34)36-12-5-7-15-40(36)44-41/h3-32H,1-2H3;2*1-27H
InChIKeyMDLQJNNSRKGXEW-UHFFFAOYSA-N
MW1800.23 g/mol
LogP36.89
Rot. Bonds12

About 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

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 (PubChem CID 159534848) has the molecular formula C135H90N4O2 and a molecular weight of 1800.23 g/mol. Its IUPAC name is 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.

Molecular Properties

Compound Name2-(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
PubChem CID159534848
Molecular FormulaC135H90N4O2
Molecular Weight1800.23 g/mol
Exact Mass1798.71
IUPAC Name2-(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
SMILESCC1(C)c2ccccc2-c2ccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5cccc(-c6ccccc6)c5)ccc43)cc21.c1ccc(-c2ccc(-c3ccc(-n4c5ccccc5c5cc(-c6cccc7oc8ccccc8c67)ccc54)cc3)cc2)cc1.c1ccc(-c2cccc(-n3c4ccccc4c4ccc(-c5ccc(-c6ccc7oc8ccccc8c7c6)cc5)cc43)c2)cc1
InChIInChI=1S/C51H36N2.2C42H27NO/c1-51(2)45-20-9-6-17-39(45)40-26-25-38(32-46(40)51)53-48-22-11-8-19-42(48)44-31-36(24-28-50(44)53)35-23-27-49-43(30-35)41-18-7-10-21-47(41)52(49)37-16-12-15-34(29-37)33-13-4-3-5-14-33;1-2-9-28(10-3-1)31-11-8-12-34(25-31)43-39-15-6-4-13-35(39)36-23-21-33(27-40(36)43)30-19-17-29(18-20-30)32-22-24-42-38(26-32)37-14-5-7-16-41(37)44-42;1-2-9-28(10-3-1)29-17-19-30(20-18-29)31-21-24-33(25-22-31)43-38-14-6-4-11-35(38)37-27-32(23-26-39(37)43)34-13-8-16-41-42(34)36-12-5-7-15-40(36)44-41/h3-32H,1-2H3;2*1-27H
InChIKeyMDLQJNNSRKGXEW-UHFFFAOYSA-N
XLogP36.89
TPSA46.00 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds12
Heavy Atoms141
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001800.23
LogP ≤ 536.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 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 with MolForge

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Frequently Asked Questions

What is the IUPAC name of 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?
The IUPAC name of 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) is 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.
What is the SMILES notation for 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?
The canonical SMILES for 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 is CC1(C)c2ccccc2-c2ccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5cccc(-c6ccccc6)c5)ccc43)cc21.c1ccc(-c2ccc(-c3ccc(-n4c5ccccc5c5cc(-c6cccc7oc8ccccc8c67)ccc54)cc3)cc2)cc1.c1ccc(-c2cccc(-n3c4ccccc4c4ccc(-c5ccc(-c6ccc7oc8ccccc8c7c6)cc5)cc43)c2)cc1.
What is the InChIKey of 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?
The InChIKey is MDLQJNNSRKGXEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C51H36N2.2C42H27NO/c1-51(2)45-20-9-6-17-39(45)40-26-25-38(32-46(40)51)53-48-22-11-8-19-42(48)44-31-36(24-28-50(44)53)35-23-27-49-43(30-35)41-18-7-10-21-47(41)52(49)37-16-12-15-34(29-37)33-13-4-3-5-14-33;1-2-9-28(10-3-1)31-11-8-12-34(25-31)43-39-15-6-4-13-35(39)36-23-21-33(27-40(36)43)30-19-17-29(18-20-30)32-22-24-42-38(26-32)37-14-5-7-16-41(37)44-42;1-2-9-28(10-3-1)29-17-19-30(20-18-29)31-21-24-33(25-22-31)43-38-14-6-4-11-35(38)37-27-32(23-26-39(37)43)34-13-8-16-41-42(34)36-12-5-7-15-40(36)44-41/h3-32H,1-2H3;2*1-27H.
What are the key properties of 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?
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 has a molecular weight of 1800.23 g/mol, XLogP of 36.89, 12 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 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 is sourced from PubChem (CID 159534848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).