3-hydroxy-2-(9-oxofluoren-4-yl)chromen-4-one

C22H12O4 — CID 22239057

IUPAC3-hydroxy-2-(9-oxofluoren-4-yl)chromen-4-one
SMILESO=C1c2ccccc2-c2c1cccc2-c1oc2ccccc2c(=O)c1O
InChIInChI=1S/C22H12O4/c23-19-13-7-2-1-6-12(13)18-15(19)9-5-10-16(18)22-21(25)20(24)14-8-3-4-11-17(14)26-22/h1-11,25H
InChIKeyMZXNTPKMXRIDGB-UHFFFAOYSA-N
MW340.33 g/mol
LogP4.38
Rot. Bonds1

About 3-hydroxy-2-(9-oxofluoren-4-yl)chromen-4-one

3-hydroxy-2-(9-oxofluoren-4-yl)chromen-4-one (PubChem CID 22239057) has the molecular formula C22H12O4 and a molecular weight of 340.33 g/mol. Its IUPAC name is 3-hydroxy-2-(9-oxofluoren-4-yl)chromen-4-one.

Molecular Properties

Compound Name3-hydroxy-2-(9-oxofluoren-4-yl)chromen-4-one
PubChem CID22239057
Molecular FormulaC22H12O4
Molecular Weight340.33 g/mol
Exact Mass340.07
IUPAC Name3-hydroxy-2-(9-oxofluoren-4-yl)chromen-4-one
SMILESO=C1c2ccccc2-c2c1cccc2-c1oc2ccccc2c(=O)c1O
InChIInChI=1S/C22H12O4/c23-19-13-7-2-1-6-12(13)18-15(19)9-5-10-16(18)22-21(25)20(24)14-8-3-4-11-17(14)26-22/h1-11,25H
InChIKeyMZXNTPKMXRIDGB-UHFFFAOYSA-N
XLogP4.38
TPSA67.51 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.33
LogP ≤ 54.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-2-(9-oxofluoren-4-yl)chromen-4-one?
The IUPAC name of 3-hydroxy-2-(9-oxofluoren-4-yl)chromen-4-one (CID 22239057) is 3-hydroxy-2-(9-oxofluoren-4-yl)chromen-4-one.
What is the SMILES notation for 3-hydroxy-2-(9-oxofluoren-4-yl)chromen-4-one?
The canonical SMILES for 3-hydroxy-2-(9-oxofluoren-4-yl)chromen-4-one is O=C1c2ccccc2-c2c1cccc2-c1oc2ccccc2c(=O)c1O.
What is the InChIKey of 3-hydroxy-2-(9-oxofluoren-4-yl)chromen-4-one?
The InChIKey is MZXNTPKMXRIDGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H12O4/c23-19-13-7-2-1-6-12(13)18-15(19)9-5-10-16(18)22-21(25)20(24)14-8-3-4-11-17(14)26-22/h1-11,25H.
What are the key properties of 3-hydroxy-2-(9-oxofluoren-4-yl)chromen-4-one?
3-hydroxy-2-(9-oxofluoren-4-yl)chromen-4-one has a molecular weight of 340.33 g/mol, XLogP of 4.38, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-2-(9-oxofluoren-4-yl)chromen-4-one is sourced from PubChem (CID 22239057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).