4-methyl-1-(2-phenylphenoxy)-2-(2-phenylphenyl)benzene

C31H24O — CID 68742549

IUPAC4-methyl-1-(2-phenylphenoxy)-2-(2-phenylphenyl)benzene
SMILESCc1ccc(Oc2ccccc2-c2ccccc2)c(-c2ccccc2-c2ccccc2)c1
InChIInChI=1S/C31H24O/c1-23-20-21-31(32-30-19-11-10-17-27(30)25-14-6-3-7-15-25)29(22-23)28-18-9-8-16-26(28)24-12-4-2-5-13-24/h2-22H,1H3
InChIKeyLRDUZMOTGMDOPC-UHFFFAOYSA-N
MW412.53 g/mol
LogP8.79
Rot. Bonds5

About 4-methyl-1-(2-phenylphenoxy)-2-(2-phenylphenyl)benzene

4-methyl-1-(2-phenylphenoxy)-2-(2-phenylphenyl)benzene (PubChem CID 68742549) has the molecular formula C31H24O and a molecular weight of 412.53 g/mol. Its IUPAC name is 4-methyl-1-(2-phenylphenoxy)-2-(2-phenylphenyl)benzene.

Molecular Properties

Compound Name4-methyl-1-(2-phenylphenoxy)-2-(2-phenylphenyl)benzene
PubChem CID68742549
Molecular FormulaC31H24O
Molecular Weight412.53 g/mol
Exact Mass412.18
IUPAC Name4-methyl-1-(2-phenylphenoxy)-2-(2-phenylphenyl)benzene
SMILESCc1ccc(Oc2ccccc2-c2ccccc2)c(-c2ccccc2-c2ccccc2)c1
InChIInChI=1S/C31H24O/c1-23-20-21-31(32-30-19-11-10-17-27(30)25-14-6-3-7-15-25)29(22-23)28-18-9-8-16-26(28)24-12-4-2-5-13-24/h2-22H,1H3
InChIKeyLRDUZMOTGMDOPC-UHFFFAOYSA-N
XLogP8.79
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500412.53
LogP ≤ 58.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

4-methyl-2-[2-(5-methyl-2-phenoxyphenyl)phenyl]-1-phenoxybenzene
CID 87662305
4-methyl-1-phenyl-2-(2-phenylphenyl)benzene
CID 59171641
1-phenyl-2-[2-[2-(2-phenylphenyl)phenoxy]phenyl]benzene
CID 67263079
tris[4-methyl-2-(2-phenylphenyl)phenoxy] phosphate
CID 139822756
2-(4-chlorophenyl)-1-[2-(4-chlorophenyl)-4-methylphenoxy]-4-methylbenzene
CID 23024265
1-(2-phenoxyphenyl)-2-(2-phenylphenoxy)benzene
CID 54513484
2-(4-methyl-2-phenylphenyl)phenol
CID 11368967
(4-methyl-2-phenylphenyl) hydrogen carbonate
CID 22141660
4-fluoro-1-methoxy-2-(2-phenylphenyl)benzene
CID 69117197
4-methyl-2-(3-methylphenyl)-1-[2-(3-methylphenyl)phenyl]benzene
CID 58892355
1-(4-fluorophenoxy)-4-methyl-2-(2-methylphenyl)benzene
CID 142805092
1,4-bis(4-methylphenoxy)-2-phenylbenzene;ethane
CID 144542678

Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-(2-phenylphenoxy)-2-(2-phenylphenyl)benzene?
The IUPAC name of 4-methyl-1-(2-phenylphenoxy)-2-(2-phenylphenyl)benzene (CID 68742549) is 4-methyl-1-(2-phenylphenoxy)-2-(2-phenylphenyl)benzene.
What is the SMILES notation for 4-methyl-1-(2-phenylphenoxy)-2-(2-phenylphenyl)benzene?
The canonical SMILES for 4-methyl-1-(2-phenylphenoxy)-2-(2-phenylphenyl)benzene is Cc1ccc(Oc2ccccc2-c2ccccc2)c(-c2ccccc2-c2ccccc2)c1.
What is the InChIKey of 4-methyl-1-(2-phenylphenoxy)-2-(2-phenylphenyl)benzene?
The InChIKey is LRDUZMOTGMDOPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H24O/c1-23-20-21-31(32-30-19-11-10-17-27(30)25-14-6-3-7-15-25)29(22-23)28-18-9-8-16-26(28)24-12-4-2-5-13-24/h2-22H,1H3.
What are the key properties of 4-methyl-1-(2-phenylphenoxy)-2-(2-phenylphenyl)benzene?
4-methyl-1-(2-phenylphenoxy)-2-(2-phenylphenyl)benzene has a molecular weight of 412.53 g/mol, XLogP of 8.79, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-(2-phenylphenoxy)-2-(2-phenylphenyl)benzene is sourced from PubChem (CID 68742549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).