1-dibenzofuran-3-yl-9-[3-(9,9-dimethylfluoren-2-yl)-5-phenylphenyl]carbazole

C51H35NO — CID 130355704

IUPAC1-dibenzofuran-3-yl-9-[3-(9,9-dimethylfluoren-2-yl)-5-phenylphenyl]carbazole
SMILESCC1(C)c2ccccc2-c2ccc(-c3cc(-c4ccccc4)cc(-n4c5ccccc5c5cccc(-c6ccc7c(c6)oc6ccccc67)c54)c3)cc21
InChIInChI=1S/C51H35NO/c1-51(2)45-20-9-6-15-39(45)40-25-23-33(30-46(40)51)36-27-35(32-13-4-3-5-14-32)28-37(29-36)52-47-21-10-7-16-41(47)44-19-12-18-38(50(44)52)34-24-26-43-42-17-8-11-22-48(42)53-49(43)31-34/h3-31H,1-2H3
InChIKeyYEJILIGNSMNRGV-UHFFFAOYSA-N
MW677.85 g/mol
LogP13.99
Rot. Bonds4

About 1-dibenzofuran-3-yl-9-[3-(9,9-dimethylfluoren-2-yl)-5-phenylphenyl]carbazole

1-dibenzofuran-3-yl-9-[3-(9,9-dimethylfluoren-2-yl)-5-phenylphenyl]carbazole (PubChem CID 130355704) has the molecular formula C51H35NO and a molecular weight of 677.85 g/mol. Its IUPAC name is 1-dibenzofuran-3-yl-9-[3-(9,9-dimethylfluoren-2-yl)-5-phenylphenyl]carbazole.

Molecular Properties

Compound Name1-dibenzofuran-3-yl-9-[3-(9,9-dimethylfluoren-2-yl)-5-phenylphenyl]carbazole
PubChem CID130355704
Molecular FormulaC51H35NO
Molecular Weight677.85 g/mol
Exact Mass677.27
IUPAC Name1-dibenzofuran-3-yl-9-[3-(9,9-dimethylfluoren-2-yl)-5-phenylphenyl]carbazole
SMILESCC1(C)c2ccccc2-c2ccc(-c3cc(-c4ccccc4)cc(-n4c5ccccc5c5cccc(-c6ccc7c(c6)oc6ccccc67)c54)c3)cc21
InChIInChI=1S/C51H35NO/c1-51(2)45-20-9-6-15-39(45)40-25-23-33(30-46(40)51)36-27-35(32-13-4-3-5-14-32)28-37(29-36)52-47-21-10-7-16-41(47)44-19-12-18-38(50(44)52)34-24-26-43-42-17-8-11-22-48(42)53-49(43)31-34/h3-31H,1-2H3
InChIKeyYEJILIGNSMNRGV-UHFFFAOYSA-N
XLogP13.99
TPSA18.07 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms53
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500677.85
LogP ≤ 513.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

9-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-1-[3-(9,9-dimethylfluoren-3-yl)phenyl]carbazole
CID 142568449
6-carbazol-9-yl-9-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)-1-[3-(9,9-dimethylfluoren-2-yl)-5-phenylphenyl]carbazole
CID 142569574
1-[3-(9,9-dimethylfluoren-2-yl)phenyl]-9-phenylcarbazole
CID 129312013
9-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-1-[3-(9,9-dimethylfluoren-3-yl)phenyl]-3-phenylcarbazole;ethane
CID 142569133
9-[3-dibenzofuran-2-yl-5-[6-(9,9-dimethylfluoren-2-yl)-2-phenylpyrimidin-4-yl]phenyl]carbazole
CID 67678611
1-[2-[4-dibenzofuran-3-yl-6-(9,9-dimethylfluoren-2-yl)-1,3,5-triazin-2-yl]carbazol-9-yl]-9-phenylcarbazole
CID 168807768
3-[3-(9,9-dimethylfluoren-2-yl)phenyl]-9-(3,5-diphenylphenyl)carbazole
CID 129311922
9-[3-carbazol-9-yl-5-(6-dibenzofuran-3-yl-2-phenylpyrimidin-4-yl)phenyl]carbazole;9-[3-carbazol-9-yl-5-[6-(9,9-dimethylfluoren-2-yl)-2-phenylpyrimidin-4-yl]phenyl]carbazole;9-[3-carbazol-9-yl-5-(6-naphthalen-1-yl-2-phenylpyrimidin-4-yl)phenyl]carbazole
CID 167665643
3-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9-(3,5-diphenylphenyl)carbazole
CID 129311960
9-[4-(4-dibenzofuran-3-ylphenyl)phenyl]-1-phenylcarbazole
CID 163676020
1-[4-(9,9-dimethylfluoren-2-yl)-6-phenyl-1,3,5-triazin-2-yl]-9-(7-phenyldibenzofuran-1-yl)carbazole
CID 170080056
5-[3-(4-dibenzofuran-3-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-4-[3-(9,9-dimethylfluoren-3-yl)phenyl]benzo[b]carbazole
CID 142569233

Frequently Asked Questions

What is the IUPAC name of 1-dibenzofuran-3-yl-9-[3-(9,9-dimethylfluoren-2-yl)-5-phenylphenyl]carbazole?
The IUPAC name of 1-dibenzofuran-3-yl-9-[3-(9,9-dimethylfluoren-2-yl)-5-phenylphenyl]carbazole (CID 130355704) is 1-dibenzofuran-3-yl-9-[3-(9,9-dimethylfluoren-2-yl)-5-phenylphenyl]carbazole.
What is the SMILES notation for 1-dibenzofuran-3-yl-9-[3-(9,9-dimethylfluoren-2-yl)-5-phenylphenyl]carbazole?
The canonical SMILES for 1-dibenzofuran-3-yl-9-[3-(9,9-dimethylfluoren-2-yl)-5-phenylphenyl]carbazole is CC1(C)c2ccccc2-c2ccc(-c3cc(-c4ccccc4)cc(-n4c5ccccc5c5cccc(-c6ccc7c(c6)oc6ccccc67)c54)c3)cc21.
What is the InChIKey of 1-dibenzofuran-3-yl-9-[3-(9,9-dimethylfluoren-2-yl)-5-phenylphenyl]carbazole?
The InChIKey is YEJILIGNSMNRGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C51H35NO/c1-51(2)45-20-9-6-15-39(45)40-25-23-33(30-46(40)51)36-27-35(32-13-4-3-5-14-32)28-37(29-36)52-47-21-10-7-16-41(47)44-19-12-18-38(50(44)52)34-24-26-43-42-17-8-11-22-48(42)53-49(43)31-34/h3-31H,1-2H3.
What are the key properties of 1-dibenzofuran-3-yl-9-[3-(9,9-dimethylfluoren-2-yl)-5-phenylphenyl]carbazole?
1-dibenzofuran-3-yl-9-[3-(9,9-dimethylfluoren-2-yl)-5-phenylphenyl]carbazole has a molecular weight of 677.85 g/mol, XLogP of 13.99, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-dibenzofuran-3-yl-9-[3-(9,9-dimethylfluoren-2-yl)-5-phenylphenyl]carbazole is sourced from PubChem (CID 130355704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).