2,7-dinaphthalen-1-ylfluoren-9-one

C33H20O — CID 146504296

IUPAC2,7-dinaphthalen-1-ylfluoren-9-one
SMILESO=C1c2cc(-c3cccc4ccccc34)ccc2-c2ccc(-c3cccc4ccccc34)cc21
InChIInChI=1S/C33H20O/c34-33-31-19-23(27-13-5-9-21-7-1-3-11-25(21)27)15-17-29(31)30-18-16-24(20-32(30)33)28-14-6-10-22-8-2-4-12-26(22)28/h1-20H
InChIKeyFQLLZPWMMPNJEL-UHFFFAOYSA-N
MW432.52 g/mol
LogP8.54
Rot. Bonds2

About 2,7-dinaphthalen-1-ylfluoren-9-one

2,7-dinaphthalen-1-ylfluoren-9-one (PubChem CID 146504296) has the molecular formula C33H20O and a molecular weight of 432.52 g/mol. Its IUPAC name is 2,7-dinaphthalen-1-ylfluoren-9-one.

Molecular Properties

Compound Name2,7-dinaphthalen-1-ylfluoren-9-one
PubChem CID146504296
Molecular FormulaC33H20O
Molecular Weight432.52 g/mol
Exact Mass432.15
IUPAC Name2,7-dinaphthalen-1-ylfluoren-9-one
SMILESO=C1c2cc(-c3cccc4ccccc34)ccc2-c2ccc(-c3cccc4ccccc34)cc21
InChIInChI=1S/C33H20O/c34-33-31-19-23(27-13-5-9-21-7-1-3-11-25(21)27)15-17-29(31)30-18-16-24(20-32(30)33)28-14-6-10-22-8-2-4-12-26(22)28/h1-20H
InChIKeyFQLLZPWMMPNJEL-UHFFFAOYSA-N
XLogP8.54
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500432.52
LogP ≤ 58.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-phenanthren-1-ylfluoren-9-one
CID 90732038
2-[5-(9,10-dioxophenanthren-2-yl)naphthalen-1-yl]phenanthrene-9,10-dione
CID 58300937
2,6-di(anthracen-1-yl)anthracene-9,10-dione
CID 174779139
1-(3-naphthalen-1-ylphenyl)-4-[4-(3-naphthalen-1-ylphenyl)naphthalen-1-yl]naphthalene
CID 123841203
1,4-bis[4-(3-naphthalen-1-ylphenyl)naphthalen-1-yl]naphthalene
CID 123399401
1-[2-(2-naphthalen-1-yl-5-pyren-1-ylphenyl)phenyl]pyrene
CID 169303134
9-benzylidene-2,7-dinaphthalen-1-ylfluorene
CID 141308479
2,7-dinaphthalen-2-ylfluoren-9-one
CID 59245491
2-naphthalen-1-ylanthracene
CID 2748705
1-(2-methyl-4-naphthalen-1-ylphenyl)naphthalene
CID 145377660
5-naphthalen-1-yl-3H-2-benzofuran-1-one
CID 102047975
9-naphthalen-1-yl-10-[4-(3-naphthalen-1-ylphenyl)naphthalen-1-yl]anthracene
CID 153466528

Frequently Asked Questions

What is the IUPAC name of 2,7-dinaphthalen-1-ylfluoren-9-one?
The IUPAC name of 2,7-dinaphthalen-1-ylfluoren-9-one (CID 146504296) is 2,7-dinaphthalen-1-ylfluoren-9-one.
What is the SMILES notation for 2,7-dinaphthalen-1-ylfluoren-9-one?
The canonical SMILES for 2,7-dinaphthalen-1-ylfluoren-9-one is O=C1c2cc(-c3cccc4ccccc34)ccc2-c2ccc(-c3cccc4ccccc34)cc21.
What is the InChIKey of 2,7-dinaphthalen-1-ylfluoren-9-one?
The InChIKey is FQLLZPWMMPNJEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H20O/c34-33-31-19-23(27-13-5-9-21-7-1-3-11-25(21)27)15-17-29(31)30-18-16-24(20-32(30)33)28-14-6-10-22-8-2-4-12-26(22)28/h1-20H.
What are the key properties of 2,7-dinaphthalen-1-ylfluoren-9-one?
2,7-dinaphthalen-1-ylfluoren-9-one has a molecular weight of 432.52 g/mol, XLogP of 8.54, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,7-dinaphthalen-1-ylfluoren-9-one is sourced from PubChem (CID 146504296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).