1-phenyl-4-[3-[3-[3-[3-(4-phenylphenyl)phenyl]phenyl]phenyl]phenyl]benzene

C48H34 — CID 12623236

IUPAC1-phenyl-4-[3-[3-[3-[3-(4-phenylphenyl)phenyl]phenyl]phenyl]phenyl]benzene
SMILESc1ccc(-c2ccc(-c3cccc(-c4cccc(-c5cccc(-c6cccc(-c7ccc(-c8ccccc8)cc7)c6)c5)c4)c3)cc2)cc1
InChIInChI=1S/C48H34/c1-3-11-35(12-4-1)37-23-27-39(28-24-37)41-15-7-17-43(31-41)45-19-9-21-47(33-45)48-22-10-20-46(34-48)44-18-8-16-42(32-44)40-29-25-38(26-30-40)36-13-5-2-6-14-36/h1-34H
InChIKeyJIUHCPGOGLTSNF-UHFFFAOYSA-N
MW610.80 g/mol
LogP13.36
Rot. Bonds7

About 1-phenyl-4-[3-[3-[3-[3-(4-phenylphenyl)phenyl]phenyl]phenyl]phenyl]benzene

1-phenyl-4-[3-[3-[3-[3-(4-phenylphenyl)phenyl]phenyl]phenyl]phenyl]benzene (PubChem CID 12623236) has the molecular formula C48H34 and a molecular weight of 610.80 g/mol. Its IUPAC name is 1-phenyl-4-[3-[3-[3-[3-(4-phenylphenyl)phenyl]phenyl]phenyl]phenyl]benzene.

Molecular Properties

Compound Name1-phenyl-4-[3-[3-[3-[3-(4-phenylphenyl)phenyl]phenyl]phenyl]phenyl]benzene
PubChem CID12623236
Molecular FormulaC48H34
Molecular Weight610.80 g/mol
Exact Mass610.27
IUPAC Name1-phenyl-4-[3-[3-[3-[3-(4-phenylphenyl)phenyl]phenyl]phenyl]phenyl]benzene
SMILESc1ccc(-c2ccc(-c3cccc(-c4cccc(-c5cccc(-c6cccc(-c7ccc(-c8ccccc8)cc7)c6)c5)c4)c3)cc2)cc1
InChIInChI=1S/C48H34/c1-3-11-35(12-4-1)37-23-27-39(28-24-37)41-15-7-17-43(31-41)45-19-9-21-47(33-45)48-22-10-20-46(34-48)44-18-8-16-42(32-44)40-29-25-38(26-30-40)36-13-5-2-6-14-36/h1-34H
InChIKeyJIUHCPGOGLTSNF-UHFFFAOYSA-N
XLogP13.36
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms48
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500610.80
LogP ≤ 513.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1,4-bis[3-(3-phenylphenyl)phenyl]benzene
CID 123341500
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-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
1,3-bis(3,5-diphenylphenyl)-5-[4-[3-[3-(3,5-diphenylphenyl)phenyl]phenyl]phenyl]benzene
CID 166563615
1-(3-phenylphenyl)-3,5-bis[3-(3-phenylphenyl)phenyl]benzene
CID 177124488
bis(1,3-diphenylbenzene);ethane
CID 144938975
1,3-diphenylbenzene;ethane;methane
CID 171489435
1,1'-biphenyl;1,3-diphenylbenzene;1,4-diphenylbenzene;ethane;toluene
CID 165006736
1,3,5-triphenylbenzene
CID 158331433
4,9,14,19,24-pentakis-phenylhexacyclo[20.3.1.12,6.17,11.112,16.117,21]triaconta-1(26),2(30),3,5,7(29),8,10,12(28),13,15,17,19,21(27),22,24-pentadecaene
CID 177480216
1,4-diphenylbenzene;1-phenyl-4-(4-phenylphenyl)benzene
CID 162098364
4-phenyl-N-(4-phenylphenyl)-N-[4-[4-[4-[3-(4-phenylphenyl)phenyl]-N-[4-[3-(4-phenylphenyl)phenyl]phenyl]anilino]phenyl]phenyl]aniline
CID 58672379

Frequently Asked Questions

What is the IUPAC name of 1-phenyl-4-[3-[3-[3-[3-(4-phenylphenyl)phenyl]phenyl]phenyl]phenyl]benzene?
The IUPAC name of 1-phenyl-4-[3-[3-[3-[3-(4-phenylphenyl)phenyl]phenyl]phenyl]phenyl]benzene (CID 12623236) is 1-phenyl-4-[3-[3-[3-[3-(4-phenylphenyl)phenyl]phenyl]phenyl]phenyl]benzene.
What is the SMILES notation for 1-phenyl-4-[3-[3-[3-[3-(4-phenylphenyl)phenyl]phenyl]phenyl]phenyl]benzene?
The canonical SMILES for 1-phenyl-4-[3-[3-[3-[3-(4-phenylphenyl)phenyl]phenyl]phenyl]phenyl]benzene is c1ccc(-c2ccc(-c3cccc(-c4cccc(-c5cccc(-c6cccc(-c7ccc(-c8ccccc8)cc7)c6)c5)c4)c3)cc2)cc1.
What is the InChIKey of 1-phenyl-4-[3-[3-[3-[3-(4-phenylphenyl)phenyl]phenyl]phenyl]phenyl]benzene?
The InChIKey is JIUHCPGOGLTSNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H34/c1-3-11-35(12-4-1)37-23-27-39(28-24-37)41-15-7-17-43(31-41)45-19-9-21-47(33-45)48-22-10-20-46(34-48)44-18-8-16-42(32-44)40-29-25-38(26-30-40)36-13-5-2-6-14-36/h1-34H.
What are the key properties of 1-phenyl-4-[3-[3-[3-[3-(4-phenylphenyl)phenyl]phenyl]phenyl]phenyl]benzene?
1-phenyl-4-[3-[3-[3-[3-(4-phenylphenyl)phenyl]phenyl]phenyl]phenyl]benzene has a molecular weight of 610.80 g/mol, XLogP of 13.36, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-4-[3-[3-[3-[3-(4-phenylphenyl)phenyl]phenyl]phenyl]phenyl]benzene is sourced from PubChem (CID 12623236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).