1-phenyl-2-[2-[2-(2-phenylphenyl)phenoxy]phenyl]benzene

C36H26O — CID 67263079

IUPAC1-phenyl-2-[2-[2-(2-phenylphenyl)phenoxy]phenyl]benzene
SMILESc1ccc(-c2ccccc2-c2ccccc2Oc2ccccc2-c2ccccc2-c2ccccc2)cc1
InChIInChI=1S/C36H26O/c1-3-15-27(16-4-1)29-19-7-9-21-31(29)33-23-11-13-25-35(33)37-36-26-14-12-24-34(36)32-22-10-8-20-30(32)28-17-5-2-6-18-28/h1-26H
InChIKeyPXPNXHSFDPNQHN-UHFFFAOYSA-N
MW474.60 g/mol
LogP10.15
Rot. Bonds6

About 1-phenyl-2-[2-[2-(2-phenylphenyl)phenoxy]phenyl]benzene

1-phenyl-2-[2-[2-(2-phenylphenyl)phenoxy]phenyl]benzene (PubChem CID 67263079) has the molecular formula C36H26O and a molecular weight of 474.60 g/mol. Its IUPAC name is 1-phenyl-2-[2-[2-(2-phenylphenyl)phenoxy]phenyl]benzene.

Molecular Properties

Compound Name1-phenyl-2-[2-[2-(2-phenylphenyl)phenoxy]phenyl]benzene
PubChem CID67263079
Molecular FormulaC36H26O
Molecular Weight474.60 g/mol
Exact Mass474.20
IUPAC Name1-phenyl-2-[2-[2-(2-phenylphenyl)phenoxy]phenyl]benzene
SMILESc1ccc(-c2ccccc2-c2ccccc2Oc2ccccc2-c2ccccc2-c2ccccc2)cc1
InChIInChI=1S/C36H26O/c1-3-15-27(16-4-1)29-19-7-9-21-31(29)33-23-11-13-25-35(33)37-36-26-14-12-24-34(36)32-22-10-8-20-30(32)28-17-5-2-6-18-28/h1-26H
InChIKeyPXPNXHSFDPNQHN-UHFFFAOYSA-N
XLogP10.15
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms37
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500474.60
LogP ≤ 510.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-(2-phenoxyphenyl)-2-(2-phenylphenoxy)benzene
CID 54513484
4-methyl-1-(2-phenylphenoxy)-2-(2-phenylphenyl)benzene
CID 68742549
methane;1-phenyl-2-(2-phenylphenyl)benzene
CID 144789864
2-phenoxy-1-[2-phenoxy-3-(2-phenylphenyl)phenoxy]-3-(2-phenylphenyl)benzene
CID 172810146
CID 69011285
CID 69011285
1,4-bis(2-phenoxyphenyl)benzene
CID 57271203
[2-(2-phenylphenyl)phenyl] methanesulfonate
CID 174491818
2-(2-phenoxyphenyl)-6-phenylbenzenethiol
CID 19734018
1-(2,4-diphenylphenoxy)-2,4-diphenylbenzene
CID 90004343
2,3,4-tris(2-phenylphenoxy)phenol
CID 67179055
9-bromo-10-(2-phenylphenoxy)anthracene
CID 86096459
2-(2,3-diphenylphenoxy)phenol
CID 66866690

Frequently Asked Questions

What is the IUPAC name of 1-phenyl-2-[2-[2-(2-phenylphenyl)phenoxy]phenyl]benzene?
The IUPAC name of 1-phenyl-2-[2-[2-(2-phenylphenyl)phenoxy]phenyl]benzene (CID 67263079) is 1-phenyl-2-[2-[2-(2-phenylphenyl)phenoxy]phenyl]benzene.
What is the SMILES notation for 1-phenyl-2-[2-[2-(2-phenylphenyl)phenoxy]phenyl]benzene?
The canonical SMILES for 1-phenyl-2-[2-[2-(2-phenylphenyl)phenoxy]phenyl]benzene is c1ccc(-c2ccccc2-c2ccccc2Oc2ccccc2-c2ccccc2-c2ccccc2)cc1.
What is the InChIKey of 1-phenyl-2-[2-[2-(2-phenylphenyl)phenoxy]phenyl]benzene?
The InChIKey is PXPNXHSFDPNQHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H26O/c1-3-15-27(16-4-1)29-19-7-9-21-31(29)33-23-11-13-25-35(33)37-36-26-14-12-24-34(36)32-22-10-8-20-30(32)28-17-5-2-6-18-28/h1-26H.
What are the key properties of 1-phenyl-2-[2-[2-(2-phenylphenyl)phenoxy]phenyl]benzene?
1-phenyl-2-[2-[2-(2-phenylphenyl)phenoxy]phenyl]benzene has a molecular weight of 474.60 g/mol, XLogP of 10.15, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-2-[2-[2-(2-phenylphenyl)phenoxy]phenyl]benzene is sourced from PubChem (CID 67263079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).