9-[4-[3-[3-[4-(3,5-diphenylphenyl)phenyl]phenyl]phenyl]phenyl]-9H-fluorene

C55H38 — CID 58556073

IUPAC9-[4-[3-[3-[4-(3,5-diphenylphenyl)phenyl]phenyl]phenyl]phenyl]-9H-fluorene
SMILESc1ccc(-c2cc(-c3ccccc3)cc(-c3ccc(-c4cccc(-c5cccc(-c6ccc(C7c8ccccc8-c8ccccc87)cc6)c5)c4)cc3)c2)cc1
InChIInChI=1S/C55H38/c1-3-13-38(14-4-1)48-35-49(39-15-5-2-6-16-39)37-50(36-48)42-27-25-40(26-28-42)44-17-11-19-46(33-44)47-20-12-18-45(34-47)41-29-31-43(32-30-41)55-53-23-9-7-21-51(53)52-22-8-10-24-54(52)55/h1-37,55H
InChIKeyCXZKKMSZGLBGGA-UHFFFAOYSA-N
MW698.91 g/mol
LogP14.85
Rot. Bonds7

About 9-[4-[3-[3-[4-(3,5-diphenylphenyl)phenyl]phenyl]phenyl]phenyl]-9H-fluorene

9-[4-[3-[3-[4-(3,5-diphenylphenyl)phenyl]phenyl]phenyl]phenyl]-9H-fluorene (PubChem CID 58556073) has the molecular formula C55H38 and a molecular weight of 698.91 g/mol. Its IUPAC name is 9-[4-[3-[3-[4-(3,5-diphenylphenyl)phenyl]phenyl]phenyl]phenyl]-9H-fluorene.

Molecular Properties

Compound Name9-[4-[3-[3-[4-(3,5-diphenylphenyl)phenyl]phenyl]phenyl]phenyl]-9H-fluorene
PubChem CID58556073
Molecular FormulaC55H38
Molecular Weight698.91 g/mol
Exact Mass698.30
IUPAC Name9-[4-[3-[3-[4-(3,5-diphenylphenyl)phenyl]phenyl]phenyl]phenyl]-9H-fluorene
SMILESc1ccc(-c2cc(-c3ccccc3)cc(-c3ccc(-c4cccc(-c5cccc(-c6ccc(C7c8ccccc8-c8ccccc87)cc6)c5)c4)cc3)c2)cc1
InChIInChI=1S/C55H38/c1-3-13-38(14-4-1)48-35-49(39-15-5-2-6-16-39)37-50(36-48)42-27-25-40(26-28-42)44-17-11-19-46(33-44)47-20-12-18-45(34-47)41-29-31-43(32-30-41)55-53-23-9-7-21-51(53)52-22-8-10-24-54(52)55/h1-37,55H
InChIKeyCXZKKMSZGLBGGA-UHFFFAOYSA-N
XLogP14.85
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms55
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500698.91
LogP ≤ 514.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

9-[4-[4-[4-(9H-fluoren-9-yl)phenyl]-2-phenylphenyl]phenyl]-9H-fluorene
CID 58556035
10-[3-(3,5-diphenylphenyl)phenyl]-8,12-diphenyl-10,12-dihydroindeno[2,1-b]fluorene
CID 158775049
9-[4-[4-[4-(9H-fluoren-9-yl)-2-phenylphenyl]phenyl]phenyl]-9H-fluorene
CID 58556038
9-[4-[3-[4-(9H-fluoren-9-yl)phenyl]-5-naphthalen-1-ylphenyl]phenyl]-9H-fluorene
CID 58556083
1-[3-[9-(3,5-diphenylphenyl)-9H-fluoren-3-yl]-9H-fluoren-9-yl]triphenylene
CID 164811988
2',7'-bis[4-(9H-fluoren-9-yl)phenyl]spiro[cyclohexane-1,9'-fluorene];9-[3-[3-[4-(3,5-diphenylphenyl)phenyl]phenyl]-5-(9H-fluoren-9-yl)phenyl]-9H-fluorene;9-[4-[4-[3-(3,5-diphenylphenyl)-5-phenylphenyl]phenyl]phenyl]-9H-fluorene
CID 158801089
9-phenyl-9H-fluorene
CID 13091
4-[3,6-bis(2-phenylphenyl)-9H-fluoren-9-yl]-N-methyl-N-phenylaniline;4-[3,6-bis(3-phenylphenyl)-9H-fluoren-9-yl]-N-methyl-N-phenylaniline;4-[3,6-bis(4-phenylphenyl)-9H-fluoren-9-yl]-N-methyl-N-phenylaniline
CID 162262327
[3-[diphenyl-(4-phenylphenyl)silyl]-5-[3-(9H-fluoren-9-yl)-5-phenylphenyl]phenyl]-diphenyl-(4-phenylphenyl)silane
CID 169031730
1-[3-(4-phenylphenyl)phenyl]-3-[3-[3-(3-phenylphenyl)phenyl]phenyl]-5-[3-[3-[3-(4-phenylphenyl)phenyl]-5-[3-[3-(3-phenylphenyl)phenyl]phenyl]phenyl]phenyl]benzene
CID 177124478
1,3-bis(3,5-diphenylphenyl)-5-[4-[3-[3-(3,5-diphenylphenyl)phenyl]phenyl]phenyl]benzene
CID 166563615
1-(3-phenylphenyl)-3-[3-[3-(4-phenylphenyl)phenyl]phenyl]-5-[3-[3-[3-(4-phenylphenyl)phenyl]phenyl]-5-[3-(3-phenylphenyl)-5-[3-[3-(4-phenylphenyl)phenyl]phenyl]phenyl]phenyl]benzene
CID 177124504

Frequently Asked Questions

What is the IUPAC name of 9-[4-[3-[3-[4-(3,5-diphenylphenyl)phenyl]phenyl]phenyl]phenyl]-9H-fluorene?
The IUPAC name of 9-[4-[3-[3-[4-(3,5-diphenylphenyl)phenyl]phenyl]phenyl]phenyl]-9H-fluorene (CID 58556073) is 9-[4-[3-[3-[4-(3,5-diphenylphenyl)phenyl]phenyl]phenyl]phenyl]-9H-fluorene.
What is the SMILES notation for 9-[4-[3-[3-[4-(3,5-diphenylphenyl)phenyl]phenyl]phenyl]phenyl]-9H-fluorene?
The canonical SMILES for 9-[4-[3-[3-[4-(3,5-diphenylphenyl)phenyl]phenyl]phenyl]phenyl]-9H-fluorene is c1ccc(-c2cc(-c3ccccc3)cc(-c3ccc(-c4cccc(-c5cccc(-c6ccc(C7c8ccccc8-c8ccccc87)cc6)c5)c4)cc3)c2)cc1.
What is the InChIKey of 9-[4-[3-[3-[4-(3,5-diphenylphenyl)phenyl]phenyl]phenyl]phenyl]-9H-fluorene?
The InChIKey is CXZKKMSZGLBGGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C55H38/c1-3-13-38(14-4-1)48-35-49(39-15-5-2-6-16-39)37-50(36-48)42-27-25-40(26-28-42)44-17-11-19-46(33-44)47-20-12-18-45(34-47)41-29-31-43(32-30-41)55-53-23-9-7-21-51(53)52-22-8-10-24-54(52)55/h1-37,55H.
What are the key properties of 9-[4-[3-[3-[4-(3,5-diphenylphenyl)phenyl]phenyl]phenyl]phenyl]-9H-fluorene?
9-[4-[3-[3-[4-(3,5-diphenylphenyl)phenyl]phenyl]phenyl]phenyl]-9H-fluorene has a molecular weight of 698.91 g/mol, XLogP of 14.85, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[4-[3-[3-[4-(3,5-diphenylphenyl)phenyl]phenyl]phenyl]phenyl]-9H-fluorene is sourced from PubChem (CID 58556073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).