2,4-dibenzyl-6-(4-benzylphenyl)phenol

C33H28O — CID 170848286

IUPAC2,4-dibenzyl-6-(4-benzylphenyl)phenol
SMILESOc1c(Cc2ccccc2)cc(Cc2ccccc2)cc1-c1ccc(Cc2ccccc2)cc1
InChIInChI=1S/C33H28O/c34-33-31(22-27-14-8-3-9-15-27)23-29(21-26-12-6-2-7-13-26)24-32(33)30-18-16-28(17-19-30)20-25-10-4-1-5-11-25/h1-19,23-24,34H,20-22H2
InChIKeyRUFMOGIDHWACQN-UHFFFAOYSA-N
MW440.59 g/mol
LogP7.83
Rot. Bonds7

About 2,4-dibenzyl-6-(4-benzylphenyl)phenol

2,4-dibenzyl-6-(4-benzylphenyl)phenol (PubChem CID 170848286) has the molecular formula C33H28O and a molecular weight of 440.59 g/mol. Its IUPAC name is 2,4-dibenzyl-6-(4-benzylphenyl)phenol.

Molecular Properties

Compound Name2,4-dibenzyl-6-(4-benzylphenyl)phenol
PubChem CID170848286
Molecular FormulaC33H28O
Molecular Weight440.59 g/mol
Exact Mass440.21
IUPAC Name2,4-dibenzyl-6-(4-benzylphenyl)phenol
SMILESOc1c(Cc2ccccc2)cc(Cc2ccccc2)cc1-c1ccc(Cc2ccccc2)cc1
InChIInChI=1S/C33H28O/c34-33-31(22-27-14-8-3-9-15-27)23-29(21-26-12-6-2-7-13-26)24-32(33)30-18-16-28(17-19-30)20-25-10-4-1-5-11-25/h1-19,23-24,34H,20-22H2
InChIKeyRUFMOGIDHWACQN-UHFFFAOYSA-N
XLogP7.83
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500440.59
LogP ≤ 57.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(3,5-dibenzyl-2-hydroxyphenyl)acetamide
CID 163237018
2-(2,3,5-tribenzylphenyl)phenol
CID 101277696
2,4-dibenzyl-6-(2-hydroxypropyl)phenol
CID 163237017
1,4-bis(4-benzylphenyl)benzene
CID 58251041
4-[[4-hydroxy-3-(4-phenylphenyl)phenyl]methyl]-2-(4-phenylphenyl)phenol
CID 121386312
2-benzyl-6-[(3-benzyl-4-hydroxy-5-methylphenyl)methyl]-4-methylphenol
CID 20743757
1-benzyl-2,4,5-triphenylbenzene
CID 143291526
2,4-dibenzyl-6-(2-methoxypropyl)phenol
CID 163237034
[5-benzyl-3-(hydroxymethyl)-2-sulfanylphenyl]methanol
CID 154195434
2-benzyl-4-[9-(3-benzyl-4-hydroxy-5-phenylphenyl)-2,7-dibromofluoren-9-yl]-6-phenylphenol
CID 177045281
4-benzyl-2-phenylbenzenethiol
CID 139607533
[4-[(4-phenylphenyl)methyl]phenyl]methanol
CID 141147437

Frequently Asked Questions

What is the IUPAC name of 2,4-dibenzyl-6-(4-benzylphenyl)phenol?
The IUPAC name of 2,4-dibenzyl-6-(4-benzylphenyl)phenol (CID 170848286) is 2,4-dibenzyl-6-(4-benzylphenyl)phenol.
What is the SMILES notation for 2,4-dibenzyl-6-(4-benzylphenyl)phenol?
The canonical SMILES for 2,4-dibenzyl-6-(4-benzylphenyl)phenol is Oc1c(Cc2ccccc2)cc(Cc2ccccc2)cc1-c1ccc(Cc2ccccc2)cc1.
What is the InChIKey of 2,4-dibenzyl-6-(4-benzylphenyl)phenol?
The InChIKey is RUFMOGIDHWACQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H28O/c34-33-31(22-27-14-8-3-9-15-27)23-29(21-26-12-6-2-7-13-26)24-32(33)30-18-16-28(17-19-30)20-25-10-4-1-5-11-25/h1-19,23-24,34H,20-22H2.
What are the key properties of 2,4-dibenzyl-6-(4-benzylphenyl)phenol?
2,4-dibenzyl-6-(4-benzylphenyl)phenol has a molecular weight of 440.59 g/mol, XLogP of 7.83, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dibenzyl-6-(4-benzylphenyl)phenol is sourced from PubChem (CID 170848286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).