2-(2-hydroxy-4,6-diphenylphenyl)-3,5-diphenylphenol

C36H26O2 — CID 19797768

IUPAC2-(2-hydroxy-4,6-diphenylphenyl)-3,5-diphenylphenol
SMILESOc1cc(-c2ccccc2)cc(-c2ccccc2)c1-c1c(O)cc(-c2ccccc2)cc1-c1ccccc1
InChIInChI=1S/C36H26O2/c37-33-23-29(25-13-5-1-6-14-25)21-31(27-17-9-3-10-18-27)35(33)36-32(28-19-11-4-12-20-28)22-30(24-34(36)38)26-15-7-2-8-16-26/h1-24,37-38H
InChIKeyPZBWYVLWGGXVAW-UHFFFAOYSA-N
MW490.60 g/mol
LogP9.43
Rot. Bonds5

About 2-(2-hydroxy-4,6-diphenylphenyl)-3,5-diphenylphenol

2-(2-hydroxy-4,6-diphenylphenyl)-3,5-diphenylphenol (PubChem CID 19797768) has the molecular formula C36H26O2 and a molecular weight of 490.60 g/mol. Its IUPAC name is 2-(2-hydroxy-4,6-diphenylphenyl)-3,5-diphenylphenol.

Molecular Properties

Compound Name2-(2-hydroxy-4,6-diphenylphenyl)-3,5-diphenylphenol
PubChem CID19797768
Molecular FormulaC36H26O2
Molecular Weight490.60 g/mol
Exact Mass490.19
IUPAC Name2-(2-hydroxy-4,6-diphenylphenyl)-3,5-diphenylphenol
SMILESOc1cc(-c2ccccc2)cc(-c2ccccc2)c1-c1c(O)cc(-c2ccccc2)cc1-c1ccccc1
InChIInChI=1S/C36H26O2/c37-33-23-29(25-13-5-1-6-14-25)21-31(27-17-9-3-10-18-27)35(33)36-32(28-19-11-4-12-20-28)22-30(24-34(36)38)26-15-7-2-8-16-26/h1-24,37-38H
InChIKeyPZBWYVLWGGXVAW-UHFFFAOYSA-N
XLogP9.43
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms38
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500490.60
LogP ≤ 59.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2-hydroxy-4,6-diphenylphenyl)-3,5-diphenylphenol?
The IUPAC name of 2-(2-hydroxy-4,6-diphenylphenyl)-3,5-diphenylphenol (CID 19797768) is 2-(2-hydroxy-4,6-diphenylphenyl)-3,5-diphenylphenol.
What is the SMILES notation for 2-(2-hydroxy-4,6-diphenylphenyl)-3,5-diphenylphenol?
The canonical SMILES for 2-(2-hydroxy-4,6-diphenylphenyl)-3,5-diphenylphenol is Oc1cc(-c2ccccc2)cc(-c2ccccc2)c1-c1c(O)cc(-c2ccccc2)cc1-c1ccccc1.
What is the InChIKey of 2-(2-hydroxy-4,6-diphenylphenyl)-3,5-diphenylphenol?
The InChIKey is PZBWYVLWGGXVAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H26O2/c37-33-23-29(25-13-5-1-6-14-25)21-31(27-17-9-3-10-18-27)35(33)36-32(28-19-11-4-12-20-28)22-30(24-34(36)38)26-15-7-2-8-16-26/h1-24,37-38H.
What are the key properties of 2-(2-hydroxy-4,6-diphenylphenyl)-3,5-diphenylphenol?
2-(2-hydroxy-4,6-diphenylphenyl)-3,5-diphenylphenol has a molecular weight of 490.60 g/mol, XLogP of 9.43, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroxy-4,6-diphenylphenyl)-3,5-diphenylphenol is sourced from PubChem (CID 19797768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).