3-(4-phenoxyphenyl)-1-phenylnaphthalene

C28H20O — CID 176904276

IUPAC3-(4-phenoxyphenyl)-1-phenylnaphthalene
SMILESc1ccc(Oc2ccc(-c3cc(-c4ccccc4)c4ccccc4c3)cc2)cc1
InChIInChI=1S/C28H20O/c1-3-9-22(10-4-1)28-20-24(19-23-11-7-8-14-27(23)28)21-15-17-26(18-16-21)29-25-12-5-2-6-13-25/h1-20H
InChIKeyLXNSPIVKGYNRQT-UHFFFAOYSA-N
MW372.47 g/mol
LogP7.97
Rot. Bonds4

About 3-(4-phenoxyphenyl)-1-phenylnaphthalene

3-(4-phenoxyphenyl)-1-phenylnaphthalene (PubChem CID 176904276) has the molecular formula C28H20O and a molecular weight of 372.47 g/mol. Its IUPAC name is 3-(4-phenoxyphenyl)-1-phenylnaphthalene.

Molecular Properties

Compound Name3-(4-phenoxyphenyl)-1-phenylnaphthalene
PubChem CID176904276
Molecular FormulaC28H20O
Molecular Weight372.47 g/mol
Exact Mass372.15
IUPAC Name3-(4-phenoxyphenyl)-1-phenylnaphthalene
SMILESc1ccc(Oc2ccc(-c3cc(-c4ccccc4)c4ccccc4c3)cc2)cc1
InChIInChI=1S/C28H20O/c1-3-9-22(10-4-1)28-20-24(19-23-11-7-8-14-27(23)28)21-15-17-26(18-16-21)29-25-12-5-2-6-13-25/h1-20H
InChIKeyLXNSPIVKGYNRQT-UHFFFAOYSA-N
XLogP7.97
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500372.47
LogP ≤ 57.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

diphenyl [3-phenyl-1-(3-phenylnaphthalen-1-yl)naphthalen-2-yl] phosphite
CID 142141354
9-[4-[4-(4-naphthalen-2-ylphenyl)phenyl]phenyl]-10-(4-phenylnaphthalen-2-yl)anthracene
CID 140754630
N-phenyl-N-[4-[4-[4-(N-(4-phenylphenyl)anilino)phenyl]naphthalen-2-yl]phenyl]naphthalen-2-amine
CID 166917627
3-bromo-1,5-diphenyl-2,4-bis(4-phenylphenoxy)benzene
CID 118220023
N-phenyl-N-[4-(4-phenylnaphthalen-2-yl)phenyl]-4-(3-phenylphenyl)aniline
CID 139352860
9-[3-(4-naphthalen-2-ylphenyl)naphthalen-1-yl]-10-phenylanthracene
CID 123234809
N-phenyl-4-(3-phenylnaphthalen-1-yl)-N-[4-(2,4,6-triphenylphenyl)phenyl]aniline
CID 156808683
1-[4-[3-(4-naphthalen-2-ylphenyl)-5-(4-phenylphenyl)phenyl]phenyl]naphthalene
CID 168844837
3-(3-fluorophenyl)-1-phenylnaphthalene
CID 176904278
N,4-diphenyl-N-[4-(4-phenylnaphthalen-2-yl)phenyl]naphthalen-1-amine
CID 139352637
9-[4-[4-(4-naphthalen-2-ylphenyl)phenyl]phenyl]-10-[4-(4-phenylnaphthalen-2-yl)phenyl]anthracene;9-[4-[4-(4-naphthalen-2-ylphenyl)phenyl]phenyl]-10-[4-(5-phenylnaphthalen-2-yl)phenyl]anthracene;9-[4-[4-(4-naphthalen-2-ylphenyl)phenyl]phenyl]-10-[4-(6-phenylnaphthalen-2-yl)phenyl]anthracene;9-[4-[4-(4-naphthalen-2-ylphenyl)phenyl]phenyl]-10-[4-(7-phenylnaphthalen-2-yl)phenyl]anthracene;9-[4-[4-(4-naphthalen-2-ylphenyl)phenyl]phenyl]-10-[4-(8-phenylnaphthalen-2-yl)phenyl]anthracene
CID 160679060
2-chloro-4-(4-phenylnaphthalen-2-yl)-6-(6-phenylnaphthalen-2-yl)-1,3,5-triazine
CID 169302466

Frequently Asked Questions

What is the IUPAC name of 3-(4-phenoxyphenyl)-1-phenylnaphthalene?
The IUPAC name of 3-(4-phenoxyphenyl)-1-phenylnaphthalene (CID 176904276) is 3-(4-phenoxyphenyl)-1-phenylnaphthalene.
What is the SMILES notation for 3-(4-phenoxyphenyl)-1-phenylnaphthalene?
The canonical SMILES for 3-(4-phenoxyphenyl)-1-phenylnaphthalene is c1ccc(Oc2ccc(-c3cc(-c4ccccc4)c4ccccc4c3)cc2)cc1.
What is the InChIKey of 3-(4-phenoxyphenyl)-1-phenylnaphthalene?
The InChIKey is LXNSPIVKGYNRQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H20O/c1-3-9-22(10-4-1)28-20-24(19-23-11-7-8-14-27(23)28)21-15-17-26(18-16-21)29-25-12-5-2-6-13-25/h1-20H.
What are the key properties of 3-(4-phenoxyphenyl)-1-phenylnaphthalene?
3-(4-phenoxyphenyl)-1-phenylnaphthalene has a molecular weight of 372.47 g/mol, XLogP of 7.97, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-phenoxyphenyl)-1-phenylnaphthalene is sourced from PubChem (CID 176904276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).