5-phenyl-4-(2-phenylphenyl)cyclohexa-2,4-diene-1,1-diol

C24H20O2 — CID 175478558

IUPAC5-phenyl-4-(2-phenylphenyl)cyclohexa-2,4-diene-1,1-diol
SMILESOC1(O)C=CC(c2ccccc2-c2ccccc2)=C(c2ccccc2)C1
InChIInChI=1S/C24H20O2/c25-24(26)16-15-22(23(17-24)19-11-5-2-6-12-19)21-14-8-7-13-20(21)18-9-3-1-4-10-18/h1-16,25-26H,17H2
InChIKeyZEMGVAFTNBFPPH-UHFFFAOYSA-N
MW340.42 g/mol
LogP4.91
Rot. Bonds3

About 5-phenyl-4-(2-phenylphenyl)cyclohexa-2,4-diene-1,1-diol

5-phenyl-4-(2-phenylphenyl)cyclohexa-2,4-diene-1,1-diol (PubChem CID 175478558) has the molecular formula C24H20O2 and a molecular weight of 340.42 g/mol. Its IUPAC name is 5-phenyl-4-(2-phenylphenyl)cyclohexa-2,4-diene-1,1-diol.

Molecular Properties

Compound Name5-phenyl-4-(2-phenylphenyl)cyclohexa-2,4-diene-1,1-diol
PubChem CID175478558
Molecular FormulaC24H20O2
Molecular Weight340.42 g/mol
Exact Mass340.15
IUPAC Name5-phenyl-4-(2-phenylphenyl)cyclohexa-2,4-diene-1,1-diol
SMILESOC1(O)C=CC(c2ccccc2-c2ccccc2)=C(c2ccccc2)C1
InChIInChI=1S/C24H20O2/c25-24(26)16-15-22(23(17-24)19-11-5-2-6-12-19)21-14-8-7-13-20(21)18-9-3-1-4-10-18/h1-16,25-26H,17H2
InChIKeyZEMGVAFTNBFPPH-UHFFFAOYSA-N
XLogP4.91
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.42
LogP ≤ 54.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'stilbene', 'substructure': 'N/A'}

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 5-phenyl-4-(2-phenylphenyl)cyclohexa-2,4-diene-1,1-diol?
The IUPAC name of 5-phenyl-4-(2-phenylphenyl)cyclohexa-2,4-diene-1,1-diol (CID 175478558) is 5-phenyl-4-(2-phenylphenyl)cyclohexa-2,4-diene-1,1-diol.
What is the SMILES notation for 5-phenyl-4-(2-phenylphenyl)cyclohexa-2,4-diene-1,1-diol?
The canonical SMILES for 5-phenyl-4-(2-phenylphenyl)cyclohexa-2,4-diene-1,1-diol is OC1(O)C=CC(c2ccccc2-c2ccccc2)=C(c2ccccc2)C1.
What is the InChIKey of 5-phenyl-4-(2-phenylphenyl)cyclohexa-2,4-diene-1,1-diol?
The InChIKey is ZEMGVAFTNBFPPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20O2/c25-24(26)16-15-22(23(17-24)19-11-5-2-6-12-19)21-14-8-7-13-20(21)18-9-3-1-4-10-18/h1-16,25-26H,17H2.
What are the key properties of 5-phenyl-4-(2-phenylphenyl)cyclohexa-2,4-diene-1,1-diol?
5-phenyl-4-(2-phenylphenyl)cyclohexa-2,4-diene-1,1-diol has a molecular weight of 340.42 g/mol, XLogP of 4.91, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-phenyl-4-(2-phenylphenyl)cyclohexa-2,4-diene-1,1-diol is sourced from PubChem (CID 175478558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).