8-phenyl-7,10-bis[3-(3-phenylphenyl)phenyl]fluoranthene

C58H38 — CID 123560042

IUPAC8-phenyl-7,10-bis[3-(3-phenylphenyl)phenyl]fluoranthene
SMILESc1ccc(-c2cccc(-c3cccc(-c4cc(-c5ccccc5)c(-c5cccc(-c6cccc(-c7ccccc7)c6)c5)c5c4-c4cccc6cccc-5c46)c3)c2)cc1
InChIInChI=1S/C58H38/c1-4-16-39(17-5-1)43-24-10-26-45(34-43)47-28-12-30-49(36-47)54-38-53(41-20-8-3-9-21-41)56(58-52-33-15-23-42-22-14-32-51(55(42)52)57(54)58)50-31-13-29-48(37-50)46-27-11-25-44(35-46)40-18-6-2-7-19-40/h1-38H
InChIKeyAVVSXYUXTLYDCC-UHFFFAOYSA-N
MW734.94 g/mol
LogP16.16
Rot. Bonds7

About 8-phenyl-7,10-bis[3-(3-phenylphenyl)phenyl]fluoranthene

8-phenyl-7,10-bis[3-(3-phenylphenyl)phenyl]fluoranthene (PubChem CID 123560042) has the molecular formula C58H38 and a molecular weight of 734.94 g/mol. Its IUPAC name is 8-phenyl-7,10-bis[3-(3-phenylphenyl)phenyl]fluoranthene.

Molecular Properties

Compound Name8-phenyl-7,10-bis[3-(3-phenylphenyl)phenyl]fluoranthene
PubChem CID123560042
Molecular FormulaC58H38
Molecular Weight734.94 g/mol
Exact Mass734.30
IUPAC Name8-phenyl-7,10-bis[3-(3-phenylphenyl)phenyl]fluoranthene
SMILESc1ccc(-c2cccc(-c3cccc(-c4cc(-c5ccccc5)c(-c5cccc(-c6cccc(-c7ccccc7)c6)c5)c5c4-c4cccc6cccc-5c46)c3)c2)cc1
InChIInChI=1S/C58H38/c1-4-16-39(17-5-1)43-24-10-26-45(34-43)47-28-12-30-49(36-47)54-38-53(41-20-8-3-9-21-41)56(58-52-33-15-23-42-22-14-32-51(55(42)52)57(54)58)50-31-13-29-48(37-50)46-27-11-25-44(35-46)40-18-6-2-7-19-40/h1-38H
InChIKeyAVVSXYUXTLYDCC-UHFFFAOYSA-N
XLogP16.16
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms58
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500734.94
LogP ≤ 516.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

7,10-diphenyl-8-(4-phenylphenyl)fluoranthene
CID 59844130
5-[3-[7,10-bis(3-phenylphenyl)fluoranthen-8-yl]phenyl]benzene-1,3-dicarbonitrile
CID 166868365
4-[3-(7,10-diphenylfluoranthen-8-yl)-5-pyridin-4-ylphenyl]pyridine
CID 118028340
4-[3-[4-[4-(7,10-diphenylfluoranthen-8-yl)phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]aniline
CID 166868488
4-[4-(7,10-diphenylfluoranthen-8-yl)phenyl]benzonitrile
CID 166868316
2-[4-(7,10-diphenylfluoranthen-8-yl)phenyl]-4,6-diphenylpyrimidine
CID 118314536
2',7'-bis(7,10-diphenylfluoranthen-8-yl)-9,9'-spirobi[fluorene]
CID 86040255
8-[3,5-bis(diphenylphosphoryl)phenyl]-7,10-diphenylfluoranthene
CID 118028356
5-(7,10-diphenylfluoranthen-8-yl)naphthalen-1-amine
CID 166868480
3,8-dinaphthalen-2-ylfluoranthene;3-naphthalen-2-yl-8,9-bis(4-naphthalen-2-ylphenyl)fluoranthene;3-naphthalen-2-yl-8-(4-naphthalen-2-ylphenyl)fluoranthene;8-(4-phenanthren-9-ylphenyl)-7,10-diphenylfluoranthene
CID 158593797
3-[3-(7,9,10-triphenylfluoranthen-2-yl)phenyl]benzonitrile
CID 166868435
4-[4-[4-(7,10-diphenylfluoranthen-8-yl)phenyl]phenyl]-2,6-dipyridin-2-ylpyridine
CID 118314559

Frequently Asked Questions

What is the IUPAC name of 8-phenyl-7,10-bis[3-(3-phenylphenyl)phenyl]fluoranthene?
The IUPAC name of 8-phenyl-7,10-bis[3-(3-phenylphenyl)phenyl]fluoranthene (CID 123560042) is 8-phenyl-7,10-bis[3-(3-phenylphenyl)phenyl]fluoranthene.
What is the SMILES notation for 8-phenyl-7,10-bis[3-(3-phenylphenyl)phenyl]fluoranthene?
The canonical SMILES for 8-phenyl-7,10-bis[3-(3-phenylphenyl)phenyl]fluoranthene is c1ccc(-c2cccc(-c3cccc(-c4cc(-c5ccccc5)c(-c5cccc(-c6cccc(-c7ccccc7)c6)c5)c5c4-c4cccc6cccc-5c46)c3)c2)cc1.
What is the InChIKey of 8-phenyl-7,10-bis[3-(3-phenylphenyl)phenyl]fluoranthene?
The InChIKey is AVVSXYUXTLYDCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C58H38/c1-4-16-39(17-5-1)43-24-10-26-45(34-43)47-28-12-30-49(36-47)54-38-53(41-20-8-3-9-21-41)56(58-52-33-15-23-42-22-14-32-51(55(42)52)57(54)58)50-31-13-29-48(37-50)46-27-11-25-44(35-46)40-18-6-2-7-19-40/h1-38H.
What are the key properties of 8-phenyl-7,10-bis[3-(3-phenylphenyl)phenyl]fluoranthene?
8-phenyl-7,10-bis[3-(3-phenylphenyl)phenyl]fluoranthene has a molecular weight of 734.94 g/mol, XLogP of 16.16, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 8-phenyl-7,10-bis[3-(3-phenylphenyl)phenyl]fluoranthene is sourced from PubChem (CID 123560042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).