2-(4-iodo-3-phenylphenyl)naphthalene

C22H15I — CID 144938534

IUPAC2-(4-iodo-3-phenylphenyl)naphthalene
SMILESIc1ccc(-c2ccc3ccccc3c2)cc1-c1ccccc1
InChIInChI=1S/C22H15I/c23-22-13-12-20(15-21(22)17-7-2-1-3-8-17)19-11-10-16-6-4-5-9-18(16)14-19/h1-15H
InChIKeyWJPHAGPSFLGGMR-UHFFFAOYSA-N
MW406.27 g/mol
LogP6.78
Rot. Bonds2

About 2-(4-iodo-3-phenylphenyl)naphthalene

2-(4-iodo-3-phenylphenyl)naphthalene (PubChem CID 144938534) has the molecular formula C22H15I and a molecular weight of 406.27 g/mol. Its IUPAC name is 2-(4-iodo-3-phenylphenyl)naphthalene.

Molecular Properties

Compound Name2-(4-iodo-3-phenylphenyl)naphthalene
PubChem CID144938534
Molecular FormulaC22H15I
Molecular Weight406.27 g/mol
Exact Mass406.02
IUPAC Name2-(4-iodo-3-phenylphenyl)naphthalene
SMILESIc1ccc(-c2ccc3ccccc3c2)cc1-c1ccccc1
InChIInChI=1S/C22H15I/c23-22-13-12-20(15-21(22)17-7-2-1-3-8-17)19-11-10-16-6-4-5-9-18(16)14-19/h1-15H
InChIKeyWJPHAGPSFLGGMR-UHFFFAOYSA-N
XLogP6.78
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500406.27
LogP ≤ 56.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

2-(3,4,5-triphenylphenyl)naphthalene
CID 54408952
benzo[f]azulene
CID 13065869
1,6-dinaphthalen-2-yl-4-phenylnaphthalene
CID 159069620
4-(3,4-dimethylphenyl)-1-iodo-2-phenylbenzene
CID 139318667
1-iodo-4-naphthalen-2-ylnaphthalene
CID 70902488
2-[6-(2,5-diphenylphenyl)naphthalen-2-yl]-4,6-dinaphthalen-2-yl-1,3,5-triazine
CID 164745860
9-[4-[4-(4-naphthalen-2-ylphenyl)phenyl]phenyl]-10-(4-phenylnaphthalen-2-yl)anthracene
CID 140754630
N-(4-naphthalen-2-ylphenyl)-4-phenyl-N-[4-[3-phenyl-4-(4-phenylphenyl)phenyl]phenyl]aniline
CID 167003722
2-(4-naphthalen-2-ylphenyl)-7-[7-(4-phenylphenyl)phenanthren-2-yl]phenanthrene
CID 59629194
2-naphthalen-2-yl-6-(3-naphthalen-2-yl-5-phenylphenyl)anthracene
CID 143886275
9-(5-naphthalen-2-yl-2-phenylphenyl)-10-(4-phenylphenyl)anthracene
CID 176775937
2,4-bis(4-naphthalen-2-ylphenyl)-6-(4-phenylphenyl)-1,3,5-triazine
CID 153292216

Frequently Asked Questions

What is the IUPAC name of 2-(4-iodo-3-phenylphenyl)naphthalene?
The IUPAC name of 2-(4-iodo-3-phenylphenyl)naphthalene (CID 144938534) is 2-(4-iodo-3-phenylphenyl)naphthalene.
What is the SMILES notation for 2-(4-iodo-3-phenylphenyl)naphthalene?
The canonical SMILES for 2-(4-iodo-3-phenylphenyl)naphthalene is Ic1ccc(-c2ccc3ccccc3c2)cc1-c1ccccc1.
What is the InChIKey of 2-(4-iodo-3-phenylphenyl)naphthalene?
The InChIKey is WJPHAGPSFLGGMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H15I/c23-22-13-12-20(15-21(22)17-7-2-1-3-8-17)19-11-10-16-6-4-5-9-18(16)14-19/h1-15H.
What are the key properties of 2-(4-iodo-3-phenylphenyl)naphthalene?
2-(4-iodo-3-phenylphenyl)naphthalene has a molecular weight of 406.27 g/mol, XLogP of 6.78, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-iodo-3-phenylphenyl)naphthalene is sourced from PubChem (CID 144938534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).