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

C32H26 — CID 174323056

IUPAC1-phenyl-4-[4-[1-(4-phenylphenyl)ethyl]phenyl]benzene
SMILESCC(c1ccc(-c2ccccc2)cc1)c1ccc(-c2ccc(-c3ccccc3)cc2)cc1
InChIInChI=1S/C32H26/c1-24(25-12-16-29(17-13-25)27-8-4-2-5-9-27)26-14-18-31(19-15-26)32-22-20-30(21-23-32)28-10-6-3-7-11-28/h2-24H,1H3
InChIKeyIHWORNHQKVXFEG-UHFFFAOYSA-N
MW410.56 g/mol
LogP8.84
Rot. Bonds5

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

1-phenyl-4-[4-[1-(4-phenylphenyl)ethyl]phenyl]benzene (PubChem CID 174323056) has the molecular formula C32H26 and a molecular weight of 410.56 g/mol. Its IUPAC name is 1-phenyl-4-[4-[1-(4-phenylphenyl)ethyl]phenyl]benzene.

Molecular Properties

Compound Name1-phenyl-4-[4-[1-(4-phenylphenyl)ethyl]phenyl]benzene
PubChem CID174323056
Molecular FormulaC32H26
Molecular Weight410.56 g/mol
Exact Mass410.20
IUPAC Name1-phenyl-4-[4-[1-(4-phenylphenyl)ethyl]phenyl]benzene
SMILESCC(c1ccc(-c2ccccc2)cc1)c1ccc(-c2ccc(-c3ccccc3)cc2)cc1
InChIInChI=1S/C32H26/c1-24(25-12-16-29(17-13-25)27-8-4-2-5-9-27)26-14-18-31(19-15-26)32-22-20-30(21-23-32)28-10-6-3-7-11-28/h2-24H,1H3
InChIKeyIHWORNHQKVXFEG-UHFFFAOYSA-N
XLogP8.84
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms32
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500410.56
LogP ≤ 58.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-phenyl-4-[4-[1-(4-phenylphenyl)ethyl]phenyl]benzene?
The IUPAC name of 1-phenyl-4-[4-[1-(4-phenylphenyl)ethyl]phenyl]benzene (CID 174323056) is 1-phenyl-4-[4-[1-(4-phenylphenyl)ethyl]phenyl]benzene.
What is the SMILES notation for 1-phenyl-4-[4-[1-(4-phenylphenyl)ethyl]phenyl]benzene?
The canonical SMILES for 1-phenyl-4-[4-[1-(4-phenylphenyl)ethyl]phenyl]benzene is CC(c1ccc(-c2ccccc2)cc1)c1ccc(-c2ccc(-c3ccccc3)cc2)cc1.
What is the InChIKey of 1-phenyl-4-[4-[1-(4-phenylphenyl)ethyl]phenyl]benzene?
The InChIKey is IHWORNHQKVXFEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H26/c1-24(25-12-16-29(17-13-25)27-8-4-2-5-9-27)26-14-18-31(19-15-26)32-22-20-30(21-23-32)28-10-6-3-7-11-28/h2-24H,1H3.
What are the key properties of 1-phenyl-4-[4-[1-(4-phenylphenyl)ethyl]phenyl]benzene?
1-phenyl-4-[4-[1-(4-phenylphenyl)ethyl]phenyl]benzene has a molecular weight of 410.56 g/mol, XLogP of 8.84, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-4-[4-[1-(4-phenylphenyl)ethyl]phenyl]benzene is sourced from PubChem (CID 174323056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).