1-(2-phenoxyphenyl)-2-(2-phenylphenoxy)benzene

C30H22O2 — CID 54513484

IUPAC1-(2-phenoxyphenyl)-2-(2-phenylphenoxy)benzene
SMILESc1ccc(Oc2ccccc2-c2ccccc2Oc2ccccc2-c2ccccc2)cc1
InChIInChI=1S/C30H22O2/c1-3-13-23(14-4-1)25-17-7-10-20-28(25)32-30-22-12-9-19-27(30)26-18-8-11-21-29(26)31-24-15-5-2-6-16-24/h1-22H
InChIKeySEPJLMHCGDCFIQ-UHFFFAOYSA-N
MW414.50 g/mol
LogP8.61
Rot. Bonds6

About 1-(2-phenoxyphenyl)-2-(2-phenylphenoxy)benzene

1-(2-phenoxyphenyl)-2-(2-phenylphenoxy)benzene (PubChem CID 54513484) has the molecular formula C30H22O2 and a molecular weight of 414.50 g/mol. Its IUPAC name is 1-(2-phenoxyphenyl)-2-(2-phenylphenoxy)benzene.

Molecular Properties

Compound Name1-(2-phenoxyphenyl)-2-(2-phenylphenoxy)benzene
PubChem CID54513484
Molecular FormulaC30H22O2
Molecular Weight414.50 g/mol
Exact Mass414.16
IUPAC Name1-(2-phenoxyphenyl)-2-(2-phenylphenoxy)benzene
SMILESc1ccc(Oc2ccccc2-c2ccccc2Oc2ccccc2-c2ccccc2)cc1
InChIInChI=1S/C30H22O2/c1-3-13-23(14-4-1)25-17-7-10-20-28(25)32-30-22-12-9-19-27(30)26-18-8-11-21-29(26)31-24-15-5-2-6-16-24/h1-22H
InChIKeySEPJLMHCGDCFIQ-UHFFFAOYSA-N
XLogP8.61
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500414.50
LogP ≤ 58.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1,4-bis(2-phenoxyphenyl)benzene
CID 57271203
1-phenyl-2-[2-[2-(2-phenylphenyl)phenoxy]phenyl]benzene
CID 67263079
2-(2-phenoxyphenyl)-6-phenylbenzenethiol
CID 19734018
1-fluoro-3-(2-phenoxyphenyl)benzene
CID 56979029
2-phenoxy-1-[2-phenoxy-3-(2-phenylphenyl)phenoxy]-3-(2-phenylphenyl)benzene
CID 172810146
1,3-diphenoxy-2-phenylbenzene
CID 88611434
1,2-bis(4-phenylphenoxy)benzene
CID 23083743
1-isocyanato-3-(2-phenylphenoxy)benzene
CID 139835407
2-methoxy-6-(2-phenoxyphenyl)naphthalene
CID 173353712
4-methyl-1-(2-phenylphenoxy)-2-(2-phenylphenyl)benzene
CID 68742549
2,3,4-tris(2-phenylphenoxy)phenol
CID 67179055
bis(2-phenylphenoxy)phosphane
CID 175384699

Frequently Asked Questions

What is the IUPAC name of 1-(2-phenoxyphenyl)-2-(2-phenylphenoxy)benzene?
The IUPAC name of 1-(2-phenoxyphenyl)-2-(2-phenylphenoxy)benzene (CID 54513484) is 1-(2-phenoxyphenyl)-2-(2-phenylphenoxy)benzene.
What is the SMILES notation for 1-(2-phenoxyphenyl)-2-(2-phenylphenoxy)benzene?
The canonical SMILES for 1-(2-phenoxyphenyl)-2-(2-phenylphenoxy)benzene is c1ccc(Oc2ccccc2-c2ccccc2Oc2ccccc2-c2ccccc2)cc1.
What is the InChIKey of 1-(2-phenoxyphenyl)-2-(2-phenylphenoxy)benzene?
The InChIKey is SEPJLMHCGDCFIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H22O2/c1-3-13-23(14-4-1)25-17-7-10-20-28(25)32-30-22-12-9-19-27(30)26-18-8-11-21-29(26)31-24-15-5-2-6-16-24/h1-22H.
What are the key properties of 1-(2-phenoxyphenyl)-2-(2-phenylphenoxy)benzene?
1-(2-phenoxyphenyl)-2-(2-phenylphenoxy)benzene has a molecular weight of 414.50 g/mol, XLogP of 8.61, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-phenoxyphenyl)-2-(2-phenylphenoxy)benzene is sourced from PubChem (CID 54513484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).