2-(2,6,7-triphenyl-9H-fluoren-3-yl)dibenzofuran

C43H28O — CID 158711757

IUPAC2-(2,6,7-triphenyl-9H-fluoren-3-yl)dibenzofuran
SMILESc1ccc(-c2cc3c(cc2-c2ccccc2)-c2cc(-c4ccc5oc6ccccc6c5c4)c(-c4ccccc4)cc2C3)cc1
InChIInChI=1S/C43H28O/c1-4-12-28(13-5-1)35-24-32-22-33-25-36(29-14-6-2-7-15-29)38(27-40(33)39(32)26-37(35)30-16-8-3-9-17-30)31-20-21-43-41(23-31)34-18-10-11-19-42(34)44-43/h1-21,23-27H,22H2
InChIKeyZQAVAZWCSODOOJ-UHFFFAOYSA-N
MW560.70 g/mol
LogP11.83
Rot. Bonds4

About 2-(2,6,7-triphenyl-9H-fluoren-3-yl)dibenzofuran

2-(2,6,7-triphenyl-9H-fluoren-3-yl)dibenzofuran (PubChem CID 158711757) has the molecular formula C43H28O and a molecular weight of 560.70 g/mol. Its IUPAC name is 2-(2,6,7-triphenyl-9H-fluoren-3-yl)dibenzofuran.

Molecular Properties

Compound Name2-(2,6,7-triphenyl-9H-fluoren-3-yl)dibenzofuran
PubChem CID158711757
Molecular FormulaC43H28O
Molecular Weight560.70 g/mol
Exact Mass560.21
IUPAC Name2-(2,6,7-triphenyl-9H-fluoren-3-yl)dibenzofuran
SMILESc1ccc(-c2cc3c(cc2-c2ccccc2)-c2cc(-c4ccc5oc6ccccc6c5c4)c(-c4ccccc4)cc2C3)cc1
InChIInChI=1S/C43H28O/c1-4-12-28(13-5-1)35-24-32-22-33-25-36(29-14-6-2-7-15-29)38(27-40(33)39(32)26-37(35)30-16-8-3-9-17-30)31-20-21-43-41(23-31)34-18-10-11-19-42(34)44-43/h1-21,23-27H,22H2
InChIKeyZQAVAZWCSODOOJ-UHFFFAOYSA-N
XLogP11.83
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms44
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500560.70
LogP ≤ 511.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2,3-diphenyldibenzofuran
CID 12699263
2,10-bis(3-phenylphenyl)-7H-fluoreno[2,3-b][1]benzofuran
CID 129231087
2,10-di(dibenzofuran-2-yl)-5,7-dihydrobenzo[d][2]benzothiepine 6,6-dioxide
CID 121441711
4-dibenzofuran-2-yl-N,3-bis(4-phenylphenyl)aniline
CID 164934515
2-(4-iodo-3,5-diphenylphenyl)dibenzofuran
CID 177108172
4-(10-dibenzofuran-2-yl-5,7-dihydrobenzo[d][2]benzoxepin-2-yl)-2,6-diphenylpyridine
CID 121441625
2-[10-[4-(4-phenylphenyl)phenyl]anthracen-9-yl]dibenzofuran
CID 135208803
10-dibenzofuran-2-yl-3-(3,5-diphenylphenyl)-5,7-dihydrobenzo[d][2]benzothiepine 6,6-dioxide
CID 121441671
2-[8-[4-(9H-fluoren-3-yl)phenyl]dibenzofuran-3-yl]-4,6-diphenyl-1,3,5-triazine
CID 171597292
2-[4-[10-(2-phenylphenyl)anthracen-9-yl]phenyl]dibenzofuran
CID 58050596
10-dibenzofuran-2-yl-2-dibenzofuran-3-yl-6-phenyl-5,7-dihydrobenzo[d][2]benzazepine
CID 121442011
2-[10-(2-dibenzofuran-3-yl-6-phenylphenyl)anthracen-9-yl]dibenzofuran
CID 171447273

Frequently Asked Questions

What is the IUPAC name of 2-(2,6,7-triphenyl-9H-fluoren-3-yl)dibenzofuran?
The IUPAC name of 2-(2,6,7-triphenyl-9H-fluoren-3-yl)dibenzofuran (CID 158711757) is 2-(2,6,7-triphenyl-9H-fluoren-3-yl)dibenzofuran.
What is the SMILES notation for 2-(2,6,7-triphenyl-9H-fluoren-3-yl)dibenzofuran?
The canonical SMILES for 2-(2,6,7-triphenyl-9H-fluoren-3-yl)dibenzofuran is c1ccc(-c2cc3c(cc2-c2ccccc2)-c2cc(-c4ccc5oc6ccccc6c5c4)c(-c4ccccc4)cc2C3)cc1.
What is the InChIKey of 2-(2,6,7-triphenyl-9H-fluoren-3-yl)dibenzofuran?
The InChIKey is ZQAVAZWCSODOOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C43H28O/c1-4-12-28(13-5-1)35-24-32-22-33-25-36(29-14-6-2-7-15-29)38(27-40(33)39(32)26-37(35)30-16-8-3-9-17-30)31-20-21-43-41(23-31)34-18-10-11-19-42(34)44-43/h1-21,23-27H,22H2.
What are the key properties of 2-(2,6,7-triphenyl-9H-fluoren-3-yl)dibenzofuran?
2-(2,6,7-triphenyl-9H-fluoren-3-yl)dibenzofuran has a molecular weight of 560.70 g/mol, XLogP of 11.83, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6,7-triphenyl-9H-fluoren-3-yl)dibenzofuran is sourced from PubChem (CID 158711757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).