1-phenoxy-4-(3-phenylphenoxy)benzene

C24H18O2 — CID 14832823

IUPAC1-phenoxy-4-(3-phenylphenoxy)benzene
SMILESc1ccc(Oc2ccc(Oc3cccc(-c4ccccc4)c3)cc2)cc1
InChIInChI=1S/C24H18O2/c1-3-8-19(9-4-1)20-10-7-13-24(18-20)26-23-16-14-22(15-17-23)25-21-11-5-2-6-12-21/h1-18H
InChIKeyXGBRGISDQIIJFK-UHFFFAOYSA-N
MW338.41 g/mol
LogP6.94
Rot. Bonds5

About 1-phenoxy-4-(3-phenylphenoxy)benzene

1-phenoxy-4-(3-phenylphenoxy)benzene (PubChem CID 14832823) has the molecular formula C24H18O2 and a molecular weight of 338.41 g/mol. Its IUPAC name is 1-phenoxy-4-(3-phenylphenoxy)benzene.

Molecular Properties

Compound Name1-phenoxy-4-(3-phenylphenoxy)benzene
PubChem CID14832823
Molecular FormulaC24H18O2
Molecular Weight338.41 g/mol
Exact Mass338.13
IUPAC Name1-phenoxy-4-(3-phenylphenoxy)benzene
SMILESc1ccc(Oc2ccc(Oc3cccc(-c4ccccc4)c3)cc2)cc1
InChIInChI=1S/C24H18O2/c1-3-8-19(9-4-1)20-10-7-13-24(18-20)26-23-16-14-22(15-17-23)25-21-11-5-2-6-12-21/h1-18H
InChIKeyXGBRGISDQIIJFK-UHFFFAOYSA-N
XLogP6.94
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500338.41
LogP ≤ 56.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-phenoxy-4-(3-phenylphenoxy)benzene?
The IUPAC name of 1-phenoxy-4-(3-phenylphenoxy)benzene (CID 14832823) is 1-phenoxy-4-(3-phenylphenoxy)benzene.
What is the SMILES notation for 1-phenoxy-4-(3-phenylphenoxy)benzene?
The canonical SMILES for 1-phenoxy-4-(3-phenylphenoxy)benzene is c1ccc(Oc2ccc(Oc3cccc(-c4ccccc4)c3)cc2)cc1.
What is the InChIKey of 1-phenoxy-4-(3-phenylphenoxy)benzene?
The InChIKey is XGBRGISDQIIJFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H18O2/c1-3-8-19(9-4-1)20-10-7-13-24(18-20)26-23-16-14-22(15-17-23)25-21-11-5-2-6-12-21/h1-18H.
What are the key properties of 1-phenoxy-4-(3-phenylphenoxy)benzene?
1-phenoxy-4-(3-phenylphenoxy)benzene has a molecular weight of 338.41 g/mol, XLogP of 6.94, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenoxy-4-(3-phenylphenoxy)benzene is sourced from PubChem (CID 14832823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).