1-[2-[2-(9-phenyl-9H-fluoren-3-yl)-9H-fluoren-9-yl]phenyl]dibenzofuran

C50H32O — CID 126753743

IUPAC1-[2-[2-(9-phenyl-9H-fluoren-3-yl)-9H-fluoren-9-yl]phenyl]dibenzofuran
SMILESc1ccc(C2c3ccccc3-c3cc(-c4ccc5c(c4)C(c4ccccc4-c4cccc6oc7ccccc7c46)c4ccccc4-5)ccc32)cc1
InChIInChI=1S/C50H32O/c1-2-13-31(14-3-1)48-38-18-7-6-17-36(38)44-29-32(26-28-42(44)48)33-25-27-37-34-15-4-8-19-39(34)49(45(37)30-33)40-20-9-5-16-35(40)41-22-12-24-47-50(41)43-21-10-11-23-46(43)51-47/h1-30,48-49H
InChIKeyPSXCOPJWQPUGKD-UHFFFAOYSA-N
MW648.81 g/mol
LogP13.24
Rot. Bonds4

About 1-[2-[2-(9-phenyl-9H-fluoren-3-yl)-9H-fluoren-9-yl]phenyl]dibenzofuran

1-[2-[2-(9-phenyl-9H-fluoren-3-yl)-9H-fluoren-9-yl]phenyl]dibenzofuran (PubChem CID 126753743) has the molecular formula C50H32O and a molecular weight of 648.81 g/mol. Its IUPAC name is 1-[2-[2-(9-phenyl-9H-fluoren-3-yl)-9H-fluoren-9-yl]phenyl]dibenzofuran.

Molecular Properties

Compound Name1-[2-[2-(9-phenyl-9H-fluoren-3-yl)-9H-fluoren-9-yl]phenyl]dibenzofuran
PubChem CID126753743
Molecular FormulaC50H32O
Molecular Weight648.81 g/mol
Exact Mass648.25
IUPAC Name1-[2-[2-(9-phenyl-9H-fluoren-3-yl)-9H-fluoren-9-yl]phenyl]dibenzofuran
SMILESc1ccc(C2c3ccccc3-c3cc(-c4ccc5c(c4)C(c4ccccc4-c4cccc6oc7ccccc7c46)c4ccccc4-5)ccc32)cc1
InChIInChI=1S/C50H32O/c1-2-13-31(14-3-1)48-38-18-7-6-17-36(38)44-29-32(26-28-42(44)48)33-25-27-37-34-15-4-8-19-39(34)49(45(37)30-33)40-20-9-5-16-35(40)41-22-12-24-47-50(41)43-21-10-11-23-46(43)51-47/h1-30,48-49H
InChIKeyPSXCOPJWQPUGKD-UHFFFAOYSA-N
XLogP13.24
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms51
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500648.81
LogP ≤ 513.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

3-[6-[2-(9-phenyl-9H-fluoren-3-yl)-9H-fluoren-9-yl]naphthalen-2-yl]dibenzofuran
CID 126753885
2-(6-dibenzofuran-1-yl-2-phenyl-9H-fluoren-9-yl)-4,6-diphenyl-1,3,5-triazine
CID 169033683
N-dibenzofuran-2-yl-8-(9-phenyl-9H-fluoren-3-yl)-N-(4-phenylphenyl)dibenzofuran-1-amine
CID 171448031
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
9-phenyl-3-[9-[4-[8-(9-phenylcarbazol-3-yl)dibenzofuran-1-yl]-6-(9-phenyl-9H-fluoren-3-yl)-1,3,5-triazin-2-yl]dibenzofuran-2-yl]carbazole
CID 167377397
2,4-diphenyl-6-[8-(9-phenyl-9H-fluoren-2-yl)dibenzofuran-3-yl]-1,3,5-triazine
CID 171597120
2-[9-[2-(9H-fluoren-4-yl)phenyl]-9H-fluoren-3-yl]-9-phenyl-9H-fluorene
CID 159754601
10-[3-(3,5-diphenylphenyl)phenyl]-8,12-diphenyl-10,12-dihydroindeno[2,1-b]fluorene
CID 158775049
3-[4-[2-[2-methyl-5-(9-phenyl-9H-fluoren-3-yl)phenyl]phenoxy]naphthalen-1-yl]dibenzofuran
CID 126760091
2-(3-dibenzofuran-1-ylphenyl)-4-[11-[4-(3-dibenzofuran-1-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-4-pentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaenyl]-6-phenyl-1,3,5-triazine
CID 165150917
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

Frequently Asked Questions

What is the IUPAC name of 1-[2-[2-(9-phenyl-9H-fluoren-3-yl)-9H-fluoren-9-yl]phenyl]dibenzofuran?
The IUPAC name of 1-[2-[2-(9-phenyl-9H-fluoren-3-yl)-9H-fluoren-9-yl]phenyl]dibenzofuran (CID 126753743) is 1-[2-[2-(9-phenyl-9H-fluoren-3-yl)-9H-fluoren-9-yl]phenyl]dibenzofuran.
What is the SMILES notation for 1-[2-[2-(9-phenyl-9H-fluoren-3-yl)-9H-fluoren-9-yl]phenyl]dibenzofuran?
The canonical SMILES for 1-[2-[2-(9-phenyl-9H-fluoren-3-yl)-9H-fluoren-9-yl]phenyl]dibenzofuran is c1ccc(C2c3ccccc3-c3cc(-c4ccc5c(c4)C(c4ccccc4-c4cccc6oc7ccccc7c46)c4ccccc4-5)ccc32)cc1.
What is the InChIKey of 1-[2-[2-(9-phenyl-9H-fluoren-3-yl)-9H-fluoren-9-yl]phenyl]dibenzofuran?
The InChIKey is PSXCOPJWQPUGKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C50H32O/c1-2-13-31(14-3-1)48-38-18-7-6-17-36(38)44-29-32(26-28-42(44)48)33-25-27-37-34-15-4-8-19-39(34)49(45(37)30-33)40-20-9-5-16-35(40)41-22-12-24-47-50(41)43-21-10-11-23-46(43)51-47/h1-30,48-49H.
What are the key properties of 1-[2-[2-(9-phenyl-9H-fluoren-3-yl)-9H-fluoren-9-yl]phenyl]dibenzofuran?
1-[2-[2-(9-phenyl-9H-fluoren-3-yl)-9H-fluoren-9-yl]phenyl]dibenzofuran has a molecular weight of 648.81 g/mol, XLogP of 13.24, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[2-(9-phenyl-9H-fluoren-3-yl)-9H-fluoren-9-yl]phenyl]dibenzofuran is sourced from PubChem (CID 126753743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).