2-(9-oxofluoren-2-yl)fluoren-9-one

C26H14O2 — CID 86119721

IUPAC2-(9-oxofluoren-2-yl)fluoren-9-one
SMILESO=C1c2ccccc2-c2ccc(-c3ccc4c(c3)C(=O)c3ccccc3-4)cc21
InChIInChI=1S/C26H14O2/c27-25-21-7-3-1-5-17(21)19-11-9-15(13-23(19)25)16-10-12-20-18-6-2-4-8-22(18)26(28)24(20)14-16/h1-14H
InChIKeyIDKUCPVVKGPDNL-UHFFFAOYSA-N
MW358.40 g/mol
LogP5.78
Rot. Bonds1

About 2-(9-oxofluoren-2-yl)fluoren-9-one

2-(9-oxofluoren-2-yl)fluoren-9-one (PubChem CID 86119721) has the molecular formula C26H14O2 and a molecular weight of 358.40 g/mol. Its IUPAC name is 2-(9-oxofluoren-2-yl)fluoren-9-one.

Molecular Properties

Compound Name2-(9-oxofluoren-2-yl)fluoren-9-one
PubChem CID86119721
Molecular FormulaC26H14O2
Molecular Weight358.40 g/mol
Exact Mass358.10
IUPAC Name2-(9-oxofluoren-2-yl)fluoren-9-one
SMILESO=C1c2ccccc2-c2ccc(-c3ccc4c(c3)C(=O)c3ccccc3-4)cc21
InChIInChI=1S/C26H14O2/c27-25-21-7-3-1-5-17(21)19-11-9-15(13-23(19)25)16-10-12-20-18-6-2-4-8-22(18)26(28)24(20)14-16/h1-14H
InChIKeyIDKUCPVVKGPDNL-UHFFFAOYSA-N
XLogP5.78
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms28
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500358.40
LogP ≤ 55.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(9-oxofluoren-2-yl)fluoren-9-one?
The IUPAC name of 2-(9-oxofluoren-2-yl)fluoren-9-one (CID 86119721) is 2-(9-oxofluoren-2-yl)fluoren-9-one.
What is the SMILES notation for 2-(9-oxofluoren-2-yl)fluoren-9-one?
The canonical SMILES for 2-(9-oxofluoren-2-yl)fluoren-9-one is O=C1c2ccccc2-c2ccc(-c3ccc4c(c3)C(=O)c3ccccc3-4)cc21.
What is the InChIKey of 2-(9-oxofluoren-2-yl)fluoren-9-one?
The InChIKey is IDKUCPVVKGPDNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H14O2/c27-25-21-7-3-1-5-17(21)19-11-9-15(13-23(19)25)16-10-12-20-18-6-2-4-8-22(18)26(28)24(20)14-16/h1-14H.
What are the key properties of 2-(9-oxofluoren-2-yl)fluoren-9-one?
2-(9-oxofluoren-2-yl)fluoren-9-one has a molecular weight of 358.40 g/mol, XLogP of 5.78, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(9-oxofluoren-2-yl)fluoren-9-one is sourced from PubChem (CID 86119721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).