9-[3-(9H-fluoren-9-yl)phenyl]-9-phenylfluorene

C38H26 — CID 123461453

IUPAC9-[3-(9H-fluoren-9-yl)phenyl]-9-phenylfluorene
SMILESc1ccc(C2(c3cccc(C4c5ccccc5-c5ccccc54)c3)c3ccccc3-c3ccccc32)cc1
InChIInChI=1S/C38H26/c1-2-14-27(15-3-1)38(35-23-10-8-19-31(35)32-20-9-11-24-36(32)38)28-16-12-13-26(25-28)37-33-21-6-4-17-29(33)30-18-5-7-22-34(30)37/h1-25,37H
InChIKeyJPUKUAVGHFOCRY-UHFFFAOYSA-N
MW482.63 g/mol
LogP9.21
Rot. Bonds3

About 9-[3-(9H-fluoren-9-yl)phenyl]-9-phenylfluorene

9-[3-(9H-fluoren-9-yl)phenyl]-9-phenylfluorene (PubChem CID 123461453) has the molecular formula C38H26 and a molecular weight of 482.63 g/mol. Its IUPAC name is 9-[3-(9H-fluoren-9-yl)phenyl]-9-phenylfluorene.

Molecular Properties

Compound Name9-[3-(9H-fluoren-9-yl)phenyl]-9-phenylfluorene
PubChem CID123461453
Molecular FormulaC38H26
Molecular Weight482.63 g/mol
Exact Mass482.20
IUPAC Name9-[3-(9H-fluoren-9-yl)phenyl]-9-phenylfluorene
SMILESc1ccc(C2(c3cccc(C4c5ccccc5-c5ccccc54)c3)c3ccccc3-c3ccccc32)cc1
InChIInChI=1S/C38H26/c1-2-14-27(15-3-1)38(35-23-10-8-19-31(35)32-20-9-11-24-36(32)38)28-16-12-13-26(25-28)37-33-21-6-4-17-29(33)30-18-5-7-22-34(30)37/h1-25,37H
InChIKeyJPUKUAVGHFOCRY-UHFFFAOYSA-N
XLogP9.21
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms38
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500482.63
LogP ≤ 59.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

4-[9,9-diphenyl-3-(9-phenyl-9H-fluoren-3-yl)fluoren-2-yl]-N,N-diphenylaniline
CID 137413930
9,9-diphenylfluorene;methane
CID 145331804
9,9-diphenylfluorene;methane
CID 145140147
9-phenyl-9H-fluorene
CID 13091
12-naphthalen-2-yl-7,7-diphenyl-3-[9-(3-phenylphenyl)-9H-fluoren-3-yl]-12H-indeno[1,2-c]fluorene
CID 159865494
9,9-bis[3-(3-phenylphenyl)phenyl]fluorene
CID 140873482
3-[9-[3-[9-(3-hydroxyphenyl)fluoren-9-yl]phenyl]fluoren-9-yl]phenol
CID 90136304
9-(2,3,4,5,6-pentadeuteriophenyl)-N,N-diphenyl-9-(9-phenyl-9H-fluoren-3-yl)fluoren-3-amine
CID 156687312
9,9-diphenylfluorene;propane
CID 158205050
9,9-diphenylfluorene;methoxymethane
CID 143139467
1-N,3-N-diphenyl-1-N,3-N-bis[3-(9-phenylfluoren-9-yl)phenyl]benzene-1,3-diamine
CID 138519596
15-methyl-10,10-diphenylhexacyclo[11.9.0.03,11.04,9.014,16.017,22]docosa-1,3(11),4,6,8,12,17,19,21-nonaene
CID 142380416

Frequently Asked Questions

What is the IUPAC name of 9-[3-(9H-fluoren-9-yl)phenyl]-9-phenylfluorene?
The IUPAC name of 9-[3-(9H-fluoren-9-yl)phenyl]-9-phenylfluorene (CID 123461453) is 9-[3-(9H-fluoren-9-yl)phenyl]-9-phenylfluorene.
What is the SMILES notation for 9-[3-(9H-fluoren-9-yl)phenyl]-9-phenylfluorene?
The canonical SMILES for 9-[3-(9H-fluoren-9-yl)phenyl]-9-phenylfluorene is c1ccc(C2(c3cccc(C4c5ccccc5-c5ccccc54)c3)c3ccccc3-c3ccccc32)cc1.
What is the InChIKey of 9-[3-(9H-fluoren-9-yl)phenyl]-9-phenylfluorene?
The InChIKey is JPUKUAVGHFOCRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C38H26/c1-2-14-27(15-3-1)38(35-23-10-8-19-31(35)32-20-9-11-24-36(32)38)28-16-12-13-26(25-28)37-33-21-6-4-17-29(33)30-18-5-7-22-34(30)37/h1-25,37H.
What are the key properties of 9-[3-(9H-fluoren-9-yl)phenyl]-9-phenylfluorene?
9-[3-(9H-fluoren-9-yl)phenyl]-9-phenylfluorene has a molecular weight of 482.63 g/mol, XLogP of 9.21, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[3-(9H-fluoren-9-yl)phenyl]-9-phenylfluorene is sourced from PubChem (CID 123461453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).