2-(2-naphthalen-1-yl-4-phenylphenyl)phenol

C28H20O — CID 174712226

IUPAC2-(2-naphthalen-1-yl-4-phenylphenyl)phenol
SMILESOc1ccccc1-c1ccc(-c2ccccc2)cc1-c1cccc2ccccc12
InChIInChI=1S/C28H20O/c29-28-16-7-6-14-26(28)25-18-17-22(20-9-2-1-3-10-20)19-27(25)24-15-8-12-21-11-4-5-13-23(21)24/h1-19,29H
InChIKeyVTEGORKINYANAM-UHFFFAOYSA-N
MW372.47 g/mol
LogP7.55
Rot. Bonds3

About 2-(2-naphthalen-1-yl-4-phenylphenyl)phenol

2-(2-naphthalen-1-yl-4-phenylphenyl)phenol (PubChem CID 174712226) has the molecular formula C28H20O and a molecular weight of 372.47 g/mol. Its IUPAC name is 2-(2-naphthalen-1-yl-4-phenylphenyl)phenol.

Molecular Properties

Compound Name2-(2-naphthalen-1-yl-4-phenylphenyl)phenol
PubChem CID174712226
Molecular FormulaC28H20O
Molecular Weight372.47 g/mol
Exact Mass372.15
IUPAC Name2-(2-naphthalen-1-yl-4-phenylphenyl)phenol
SMILESOc1ccccc1-c1ccc(-c2ccccc2)cc1-c1cccc2ccccc12
InChIInChI=1S/C28H20O/c29-28-16-7-6-14-26(28)25-18-17-22(20-9-2-1-3-10-20)19-27(25)24-15-8-12-21-11-4-5-13-23(21)24/h1-19,29H
InChIKeyVTEGORKINYANAM-UHFFFAOYSA-N
XLogP7.55
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500372.47
LogP ≤ 57.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-Naphthol
CID 7005
9-Phenanthrol
CID 10229
1-Hydroxypyrene
CID 21387
trans-Ferruginol
CID 442027
Menadiol
CID 10209
3-Methylanthralin
CID 10288
1,8,9-Anthracenetriol
CID 10187
1,1'-Methylenebis(2-naphthalenol)
CID 14187
3-Phenanthrol
CID 95724
1,1-Bis(3-cyclohexyl-4-hydroxyphenyl)cyclohexane
CID 21943953
9-Hydroxybenzo(a)pyrene
CID 28598
1,3,5-Trimethyl-2,4,6-tris(3,5-di-tert-butyl-4-hydroxybenzyl)benzene
CID 74370

Frequently Asked Questions

What is the IUPAC name of 2-(2-naphthalen-1-yl-4-phenylphenyl)phenol?
The IUPAC name of 2-(2-naphthalen-1-yl-4-phenylphenyl)phenol (CID 174712226) is 2-(2-naphthalen-1-yl-4-phenylphenyl)phenol.
What is the SMILES notation for 2-(2-naphthalen-1-yl-4-phenylphenyl)phenol?
The canonical SMILES for 2-(2-naphthalen-1-yl-4-phenylphenyl)phenol is Oc1ccccc1-c1ccc(-c2ccccc2)cc1-c1cccc2ccccc12.
What is the InChIKey of 2-(2-naphthalen-1-yl-4-phenylphenyl)phenol?
The InChIKey is VTEGORKINYANAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H20O/c29-28-16-7-6-14-26(28)25-18-17-22(20-9-2-1-3-10-20)19-27(25)24-15-8-12-21-11-4-5-13-23(21)24/h1-19,29H.
What are the key properties of 2-(2-naphthalen-1-yl-4-phenylphenyl)phenol?
2-(2-naphthalen-1-yl-4-phenylphenyl)phenol has a molecular weight of 372.47 g/mol, XLogP of 7.55, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-naphthalen-1-yl-4-phenylphenyl)phenol is sourced from PubChem (CID 174712226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).