2-phenyl-6-(2-phenylpropan-2-yl)phenol

C21H20O — CID 20572334

IUPAC2-phenyl-6-(2-phenylpropan-2-yl)phenol
SMILESCC(C)(c1ccccc1)c1cccc(-c2ccccc2)c1O
InChIInChI=1S/C21H20O/c1-21(2,17-12-7-4-8-13-17)19-15-9-14-18(20(19)22)16-10-5-3-6-11-16/h3-15,22H,1-2H3
InChIKeyZKFVMKDSLDLENA-UHFFFAOYSA-N
MW288.39 g/mol
LogP5.39
Rot. Bonds3

About 2-phenyl-6-(2-phenylpropan-2-yl)phenol

2-phenyl-6-(2-phenylpropan-2-yl)phenol (PubChem CID 20572334) has the molecular formula C21H20O and a molecular weight of 288.39 g/mol. Its IUPAC name is 2-phenyl-6-(2-phenylpropan-2-yl)phenol.

Molecular Properties

Compound Name2-phenyl-6-(2-phenylpropan-2-yl)phenol
PubChem CID20572334
Molecular FormulaC21H20O
Molecular Weight288.39 g/mol
Exact Mass288.15
IUPAC Name2-phenyl-6-(2-phenylpropan-2-yl)phenol
SMILESCC(C)(c1ccccc1)c1cccc(-c2ccccc2)c1O
InChIInChI=1S/C21H20O/c1-21(2,17-12-7-4-8-13-17)19-15-9-14-18(20(19)22)16-10-5-3-6-11-16/h3-15,22H,1-2H3
InChIKeyZKFVMKDSLDLENA-UHFFFAOYSA-N
XLogP5.39
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500288.39
LogP ≤ 55.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-phenyl-6-(2-phenylpropan-2-yl)phenol?
The IUPAC name of 2-phenyl-6-(2-phenylpropan-2-yl)phenol (CID 20572334) is 2-phenyl-6-(2-phenylpropan-2-yl)phenol.
What is the SMILES notation for 2-phenyl-6-(2-phenylpropan-2-yl)phenol?
The canonical SMILES for 2-phenyl-6-(2-phenylpropan-2-yl)phenol is CC(C)(c1ccccc1)c1cccc(-c2ccccc2)c1O.
What is the InChIKey of 2-phenyl-6-(2-phenylpropan-2-yl)phenol?
The InChIKey is ZKFVMKDSLDLENA-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20O/c1-21(2,17-12-7-4-8-13-17)19-15-9-14-18(20(19)22)16-10-5-3-6-11-16/h3-15,22H,1-2H3.
What are the key properties of 2-phenyl-6-(2-phenylpropan-2-yl)phenol?
2-phenyl-6-(2-phenylpropan-2-yl)phenol has a molecular weight of 288.39 g/mol, XLogP of 5.39, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-6-(2-phenylpropan-2-yl)phenol is sourced from PubChem (CID 20572334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).