2,9-diphenylfluoranthene

C28H18 — CID 174565991

IUPAC2,9-diphenylfluoranthene
SMILESc1ccc(-c2ccc3c(c2)-c2cc(-c4ccccc4)cc4cccc-3c24)cc1
InChIInChI=1S/C28H18/c1-3-8-19(9-4-1)21-14-15-24-25-13-7-12-22-16-23(20-10-5-2-6-11-20)18-27(28(22)25)26(24)17-21/h1-18H
InChIKeyHNAJNTBYLDCPQX-UHFFFAOYSA-N
MW354.45 g/mol
LogP7.82
Rot. Bonds2

About 2,9-diphenylfluoranthene

2,9-diphenylfluoranthene (PubChem CID 174565991) has the molecular formula C28H18 and a molecular weight of 354.45 g/mol. Its IUPAC name is 2,9-diphenylfluoranthene.

Molecular Properties

Compound Name2,9-diphenylfluoranthene
PubChem CID174565991
Molecular FormulaC28H18
Molecular Weight354.45 g/mol
Exact Mass354.14
IUPAC Name2,9-diphenylfluoranthene
SMILESc1ccc(-c2ccc3c(c2)-c2cc(-c4ccccc4)cc4cccc-3c24)cc1
InChIInChI=1S/C28H18/c1-3-8-19(9-4-1)21-14-15-24-25-13-7-12-22-16-23(20-10-5-2-6-11-20)18-27(28(22)25)26(24)17-21/h1-18H
InChIKeyHNAJNTBYLDCPQX-UHFFFAOYSA-N
XLogP7.82
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500354.45
LogP ≤ 57.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

2-[6-(6-phenylnaphthalen-2-yl)naphthalen-2-yl]fluoranthene
CID 140801800
2,4-diphenyl-6-(9-phenylfluoranthen-2-yl)-1,3,5-triazine
CID 155404604
2-[4-(4-naphthalen-2-ylphenyl)phenyl]fluoranthene
CID 140801763
2-(3-fluoranthen-2-ylphenyl)-4,6-bis(4-phenylphenyl)pyrimidine
CID 130295035
4-[4-(3-fluoranthen-2-ylphenyl)phenyl]-2-phenyl-6-(4-phenylphenyl)pyrimidine
CID 130295026
4-(4-fluoranthen-2-ylphenyl)-2-phenyl-6-(4-phenylphenyl)pyrimidine
CID 130295244
4-[4-(4-fluoranthen-2-ylphenyl)phenyl]-2-phenyl-6-(3-phenylphenyl)pyrimidine
CID 130295102
4-(4-fluoranthen-2-ylphenyl)pyridine
CID 130295099
4-(6-fluoranthen-2-ylnaphthalen-2-yl)pyridine
CID 130295175
2-(6-fluoranthen-2-ylnaphthalen-2-yl)-4,6-diphenylpyrimidine
CID 130295192
3-[4-(6-fluoranthen-2-ylnaphthalen-2-yl)phenyl]pyridine
CID 130295169
9-(3-fluoranthen-2-ylphenyl)-3,6-diphenylcarbazole
CID 130294968

Frequently Asked Questions

What is the IUPAC name of 2,9-diphenylfluoranthene?
The IUPAC name of 2,9-diphenylfluoranthene (CID 174565991) is 2,9-diphenylfluoranthene.
What is the SMILES notation for 2,9-diphenylfluoranthene?
The canonical SMILES for 2,9-diphenylfluoranthene is c1ccc(-c2ccc3c(c2)-c2cc(-c4ccccc4)cc4cccc-3c24)cc1.
What is the InChIKey of 2,9-diphenylfluoranthene?
The InChIKey is HNAJNTBYLDCPQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H18/c1-3-8-19(9-4-1)21-14-15-24-25-13-7-12-22-16-23(20-10-5-2-6-11-20)18-27(28(22)25)26(24)17-21/h1-18H.
What are the key properties of 2,9-diphenylfluoranthene?
2,9-diphenylfluoranthene has a molecular weight of 354.45 g/mol, XLogP of 7.82, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,9-diphenylfluoranthene is sourced from PubChem (CID 174565991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).