3-[6-[2-(9-phenyl-9H-fluoren-3-yl)-9H-fluoren-9-yl]naphthalen-2-yl]dibenzofuran

C54H34O — CID 126753885

IUPAC3-[6-[2-(9-phenyl-9H-fluoren-3-yl)-9H-fluoren-9-yl]naphthalen-2-yl]dibenzofuran
SMILESc1ccc(C2c3ccccc3-c3cc(-c4ccc5c(c4)C(c4ccc6cc(-c7ccc8c(c7)oc7ccccc78)ccc6c4)c4ccccc4-5)ccc32)cc1
InChIInChI=1S/C54H34O/c1-2-10-33(11-3-1)53-47-16-7-5-13-42(47)49-30-37(24-27-48(49)53)38-22-25-43-41-12-4-6-15-46(41)54(50(43)31-38)40-21-20-34-28-35(18-19-36(34)29-40)39-23-26-45-44-14-8-9-17-51(44)55-52(45)32-39/h1-32,53-54H
InChIKeyYVEGANZNFMRLHJ-UHFFFAOYSA-N
MW698.87 g/mol
LogP14.39
Rot. Bonds4

About 3-[6-[2-(9-phenyl-9H-fluoren-3-yl)-9H-fluoren-9-yl]naphthalen-2-yl]dibenzofuran

3-[6-[2-(9-phenyl-9H-fluoren-3-yl)-9H-fluoren-9-yl]naphthalen-2-yl]dibenzofuran (PubChem CID 126753885) has the molecular formula C54H34O and a molecular weight of 698.87 g/mol. Its IUPAC name is 3-[6-[2-(9-phenyl-9H-fluoren-3-yl)-9H-fluoren-9-yl]naphthalen-2-yl]dibenzofuran.

Molecular Properties

Compound Name3-[6-[2-(9-phenyl-9H-fluoren-3-yl)-9H-fluoren-9-yl]naphthalen-2-yl]dibenzofuran
PubChem CID126753885
Molecular FormulaC54H34O
Molecular Weight698.87 g/mol
Exact Mass698.26
IUPAC Name3-[6-[2-(9-phenyl-9H-fluoren-3-yl)-9H-fluoren-9-yl]naphthalen-2-yl]dibenzofuran
SMILESc1ccc(C2c3ccccc3-c3cc(-c4ccc5c(c4)C(c4ccc6cc(-c7ccc8c(c7)oc7ccccc78)ccc6c4)c4ccccc4-5)ccc32)cc1
InChIInChI=1S/C54H34O/c1-2-10-33(11-3-1)53-47-16-7-5-13-42(47)49-30-37(24-27-48(49)53)38-22-25-43-41-12-4-6-15-46(41)54(50(43)31-38)40-21-20-34-28-35(18-19-36(34)29-40)39-23-26-45-44-14-8-9-17-51(44)55-52(45)32-39/h1-32,53-54H
InChIKeyYVEGANZNFMRLHJ-UHFFFAOYSA-N
XLogP14.39
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms55
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500698.87
LogP ≤ 514.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-[2-[2-(9-phenyl-9H-fluoren-3-yl)-9H-fluoren-9-yl]phenyl]dibenzofuran
CID 126753743
2,4-diphenyl-6-[8-(9-phenyl-9H-fluoren-2-yl)dibenzofuran-3-yl]-1,3,5-triazine
CID 171597120
3-[4-[2-[2-methyl-5-(9-phenyl-9H-fluoren-3-yl)phenyl]phenoxy]naphthalen-1-yl]dibenzofuran
CID 126760091
3-naphthalen-2-yldibenzofuran
CID 68932481
24-phenyl-28-(9-phenyl-9H-fluoren-3-yl)-14-oxa-24-azaheptacyclo[19.11.0.02,7.08,13.015,20.023,31.025,30]dotriaconta-1(32),2,4,6,8,10,12,15,17,19,21,23(31),25(30),26,28-pentadecaene
CID 130323535
3-[7-(2,7-diphenyl-9H-fluoren-9-yl)dibenzofuran-1-yl]-1-(4-phenylphenyl)isoquinoline
CID 146337586
3-[9-(3-dibenzofuran-2-ylphenyl)-9H-fluoren-3-yl]-9-phenylcarbazole
CID 126753873
N-dibenzofuran-2-yl-8-(9-phenyl-9H-fluoren-3-yl)-N-(4-phenylphenyl)dibenzofuran-1-amine
CID 171448031
11-(7-dibenzofuran-3-yldibenzofuran-3-yl)-12-phenyl-12H-indeno[2,1-a]carbazole
CID 170285824
3-[9-[6-(9H-fluoren-2-yl)naphthalen-2-yl]-9H-fluoren-2-yl]-9-phenyl-9H-fluorene;3-[9-[6-(9H-fluoren-3-yl)naphthalen-2-yl]-9H-fluoren-2-yl]-9-phenyl-9H-fluorene;9-[6-(9H-fluoren-1-yl)naphthalen-2-yl]-2-(9-phenyl-9H-fluoren-3-yl)carbazole
CID 157094709
6-(9-phenylcarbazol-3-yl)-1-(9-phenyl-9H-fluoren-3-yl)xanthen-9-one
CID 135232595
3-(9-dibenzofuran-2-yl-9H-fluoren-3-yl)-9-(3-dibenzofuran-2-ylphenyl)carbazole
CID 163643866

Frequently Asked Questions

What is the IUPAC name of 3-[6-[2-(9-phenyl-9H-fluoren-3-yl)-9H-fluoren-9-yl]naphthalen-2-yl]dibenzofuran?
The IUPAC name of 3-[6-[2-(9-phenyl-9H-fluoren-3-yl)-9H-fluoren-9-yl]naphthalen-2-yl]dibenzofuran (CID 126753885) is 3-[6-[2-(9-phenyl-9H-fluoren-3-yl)-9H-fluoren-9-yl]naphthalen-2-yl]dibenzofuran.
What is the SMILES notation for 3-[6-[2-(9-phenyl-9H-fluoren-3-yl)-9H-fluoren-9-yl]naphthalen-2-yl]dibenzofuran?
The canonical SMILES for 3-[6-[2-(9-phenyl-9H-fluoren-3-yl)-9H-fluoren-9-yl]naphthalen-2-yl]dibenzofuran is c1ccc(C2c3ccccc3-c3cc(-c4ccc5c(c4)C(c4ccc6cc(-c7ccc8c(c7)oc7ccccc78)ccc6c4)c4ccccc4-5)ccc32)cc1.
What is the InChIKey of 3-[6-[2-(9-phenyl-9H-fluoren-3-yl)-9H-fluoren-9-yl]naphthalen-2-yl]dibenzofuran?
The InChIKey is YVEGANZNFMRLHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C54H34O/c1-2-10-33(11-3-1)53-47-16-7-5-13-42(47)49-30-37(24-27-48(49)53)38-22-25-43-41-12-4-6-15-46(41)54(50(43)31-38)40-21-20-34-28-35(18-19-36(34)29-40)39-23-26-45-44-14-8-9-17-51(44)55-52(45)32-39/h1-32,53-54H.
What are the key properties of 3-[6-[2-(9-phenyl-9H-fluoren-3-yl)-9H-fluoren-9-yl]naphthalen-2-yl]dibenzofuran?
3-[6-[2-(9-phenyl-9H-fluoren-3-yl)-9H-fluoren-9-yl]naphthalen-2-yl]dibenzofuran has a molecular weight of 698.87 g/mol, XLogP of 14.39, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[6-[2-(9-phenyl-9H-fluoren-3-yl)-9H-fluoren-9-yl]naphthalen-2-yl]dibenzofuran is sourced from PubChem (CID 126753885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).