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

C33H20O — CID 59245491

IUPAC2,7-dinaphthalen-2-ylfluoren-9-one
SMILESO=C1c2cc(-c3ccc4ccccc4c3)ccc2-c2ccc(-c3ccc4ccccc4c3)cc21
InChIInChI=1S/C33H20O/c34-33-31-19-27(25-11-9-21-5-1-3-7-23(21)17-25)13-15-29(31)30-16-14-28(20-32(30)33)26-12-10-22-6-2-4-8-24(22)18-26/h1-20H
InChIKeyIODGLHOKYPWLJX-UHFFFAOYSA-N
MW432.52 g/mol
LogP8.54
Rot. Bonds2

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

2,7-dinaphthalen-2-ylfluoren-9-one (PubChem CID 59245491) has the molecular formula C33H20O and a molecular weight of 432.52 g/mol. Its IUPAC name is 2,7-dinaphthalen-2-ylfluoren-9-one.

Molecular Properties

Compound Name2,7-dinaphthalen-2-ylfluoren-9-one
PubChem CID59245491
Molecular FormulaC33H20O
Molecular Weight432.52 g/mol
Exact Mass432.15
IUPAC Name2,7-dinaphthalen-2-ylfluoren-9-one
SMILESO=C1c2cc(-c3ccc4ccccc4c3)ccc2-c2ccc(-c3ccc4ccccc4c3)cc21
InChIInChI=1S/C33H20O/c34-33-31-19-27(25-11-9-21-5-1-3-7-23(21)17-25)13-15-29(31)30-16-14-28(20-32(30)33)26-12-10-22-6-2-4-8-24(22)18-26/h1-20H
InChIKeyIODGLHOKYPWLJX-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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Frequently Asked Questions

What is the IUPAC name of 2,7-dinaphthalen-2-ylfluoren-9-one?
The IUPAC name of 2,7-dinaphthalen-2-ylfluoren-9-one (CID 59245491) is 2,7-dinaphthalen-2-ylfluoren-9-one.
What is the SMILES notation for 2,7-dinaphthalen-2-ylfluoren-9-one?
The canonical SMILES for 2,7-dinaphthalen-2-ylfluoren-9-one is O=C1c2cc(-c3ccc4ccccc4c3)ccc2-c2ccc(-c3ccc4ccccc4c3)cc21.
What is the InChIKey of 2,7-dinaphthalen-2-ylfluoren-9-one?
The InChIKey is IODGLHOKYPWLJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H20O/c34-33-31-19-27(25-11-9-21-5-1-3-7-23(21)17-25)13-15-29(31)30-16-14-28(20-32(30)33)26-12-10-22-6-2-4-8-24(22)18-26/h1-20H.
What are the key properties of 2,7-dinaphthalen-2-ylfluoren-9-one?
2,7-dinaphthalen-2-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-2-ylfluoren-9-one is sourced from PubChem (CID 59245491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).