3-(6-phenylnaphthalen-2-yl)fluoranthene

C32H20 — CID 123421019

IUPAC3-(6-phenylnaphthalen-2-yl)fluoranthene
SMILESc1ccc(-c2ccc3cc(-c4ccc5c6c(cccc46)-c4ccccc4-5)ccc3c2)cc1
InChIInChI=1S/C32H20/c1-2-7-21(8-3-1)22-13-14-24-20-25(16-15-23(24)19-22)26-17-18-31-28-10-5-4-9-27(28)30-12-6-11-29(26)32(30)31/h1-20H
InChIKeyKEMCZLWVDSAKTN-UHFFFAOYSA-N
MW404.51 g/mol
LogP8.97
Rot. Bonds2

About 3-(6-phenylnaphthalen-2-yl)fluoranthene

3-(6-phenylnaphthalen-2-yl)fluoranthene (PubChem CID 123421019) has the molecular formula C32H20 and a molecular weight of 404.51 g/mol. Its IUPAC name is 3-(6-phenylnaphthalen-2-yl)fluoranthene.

Molecular Properties

Compound Name3-(6-phenylnaphthalen-2-yl)fluoranthene
PubChem CID123421019
Molecular FormulaC32H20
Molecular Weight404.51 g/mol
Exact Mass404.16
IUPAC Name3-(6-phenylnaphthalen-2-yl)fluoranthene
SMILESc1ccc(-c2ccc3cc(-c4ccc5c6c(cccc46)-c4ccccc4-5)ccc3c2)cc1
InChIInChI=1S/C32H20/c1-2-7-21(8-3-1)22-13-14-24-20-25(16-15-23(24)19-22)26-17-18-31-28-10-5-4-9-27(28)30-12-6-11-29(26)32(30)31/h1-20H
InChIKeyKEMCZLWVDSAKTN-UHFFFAOYSA-N
XLogP8.97
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500404.51
LogP ≤ 58.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

3-[7-(4-naphthalen-2-ylphenyl)naphthalen-2-yl]fluoranthene
CID 58544598
3-[3-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]fluoranthene
CID 59524105
3-[3-[3-(4-phenylphenyl)phenyl]phenyl]fluoranthene
CID 58995572
3-[7-(3-naphthalen-2-ylphenyl)naphthalen-2-yl]-8-phenylfluoranthene
CID 58544667
3-(6-naphthalen-2-ylnaphthalen-2-yl)benzo[k]fluoranthene
CID 166019533
4,5-dinaphthalen-1-yl-1-(6-naphthalen-2-ylnaphthalen-2-yl)naphthalene
CID 159717839
3-(6-phenanthren-9-ylnaphthalen-2-yl)fluoranthene
CID 123939461
1-(4,5-diphenylnaphthalen-1-yl)-6-(4-naphthalen-2-ylphenyl)pyrene
CID 123142819
3-(7-benzo[k]fluoranthen-3-ylnaphthalen-2-yl)benzo[k]fluoranthene
CID 59805129
6-(3-fluoranthen-3-ylphenyl)isoquinoline
CID 121287554
3-(4-naphthalen-2-ylphenyl)-7,12-diphenylbenzo[k]fluoranthene
CID 140717774
1-(3-naphthalen-2-ylphenyl)-6-[3-[3-[3-(6-phenylpyren-1-yl)phenyl]phenyl]phenyl]pyrene;1-(3-naphthalen-2-ylphenyl)-6-[3-[3-(3-pyren-1-ylphenyl)phenyl]phenyl]pyrene;1-(4-naphthalen-1-ylphenyl)-6-[4-[3-(4-pyren-1-ylphenyl)phenyl]phenyl]pyrene;1-[3-[2-[2-(3-pyren-1-ylphenyl)phenyl]phenyl]phenyl]pyrene;1-[4-[2-[2-(4-pyren-1-ylphenyl)phenyl]phenyl]phenyl]pyrene;1-[3-[3-(3-pyren-1-ylphenyl)phenyl]phenyl]pyrene
CID 159994110

Frequently Asked Questions

What is the IUPAC name of 3-(6-phenylnaphthalen-2-yl)fluoranthene?
The IUPAC name of 3-(6-phenylnaphthalen-2-yl)fluoranthene (CID 123421019) is 3-(6-phenylnaphthalen-2-yl)fluoranthene.
What is the SMILES notation for 3-(6-phenylnaphthalen-2-yl)fluoranthene?
The canonical SMILES for 3-(6-phenylnaphthalen-2-yl)fluoranthene is c1ccc(-c2ccc3cc(-c4ccc5c6c(cccc46)-c4ccccc4-5)ccc3c2)cc1.
What is the InChIKey of 3-(6-phenylnaphthalen-2-yl)fluoranthene?
The InChIKey is KEMCZLWVDSAKTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H20/c1-2-7-21(8-3-1)22-13-14-24-20-25(16-15-23(24)19-22)26-17-18-31-28-10-5-4-9-27(28)30-12-6-11-29(26)32(30)31/h1-20H.
What are the key properties of 3-(6-phenylnaphthalen-2-yl)fluoranthene?
3-(6-phenylnaphthalen-2-yl)fluoranthene has a molecular weight of 404.51 g/mol, XLogP of 8.97, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(6-phenylnaphthalen-2-yl)fluoranthene is sourced from PubChem (CID 123421019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).