5-chloro-2-fluorofluoren-9-one

C13H6ClFO — CID 82579497

IUPAC5-chloro-2-fluorofluoren-9-one
SMILESO=C1c2cc(F)ccc2-c2c(Cl)cccc21
InChIInChI=1S/C13H6ClFO/c14-11-3-1-2-9-12(11)8-5-4-7(15)6-10(8)13(9)16/h1-6H
InChIKeyVXVUBINSTHTUJF-UHFFFAOYSA-N
MW232.64 g/mol
LogP3.69
Rot. Bonds

About 5-chloro-2-fluorofluoren-9-one

5-chloro-2-fluorofluoren-9-one (PubChem CID 82579497) has the molecular formula C13H6ClFO and a molecular weight of 232.64 g/mol. Its IUPAC name is 5-chloro-2-fluorofluoren-9-one.

Molecular Properties

Compound Name5-chloro-2-fluorofluoren-9-one
PubChem CID82579497
Molecular FormulaC13H6ClFO
Molecular Weight232.64 g/mol
Exact Mass232.01
IUPAC Name5-chloro-2-fluorofluoren-9-one
SMILESO=C1c2cc(F)ccc2-c2c(Cl)cccc21
InChIInChI=1S/C13H6ClFO/c14-11-3-1-2-9-12(11)8-5-4-7(15)6-10(8)13(9)16/h1-6H
InChIKeyVXVUBINSTHTUJF-UHFFFAOYSA-N
XLogP3.69
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.64
LogP ≤ 53.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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3,4,5-trichlorofluoren-9-one
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2-fluoro-5,6-dimethylfluoren-9-one
CID 82579570
sodium 8-chloro-9,10-dioxoanthracene-2-sulfonate
CID 44784325
1-chloro-2-(4-fluoro-2-methylphenyl)-3-methylbenzene
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3-(2,6-dichlorophenyl)-5-fluoro-1H-pyridin-2-one
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anthracene-9,10-dione;1-chloroanthracene-9,10-dione;2-chloroanthracene-9,10-dione;ethane;2-methylanthracene-9,10-dione
CID 174912168
1-chloro-5-hydroxyanthracene-9,10-dione
CID 12631756
1-chloro-2-(2,4-difluorophenyl)-3-methylbenzene;ethane
CID 156797432
7-chloro-1-[(2-chloro-5-fluorophenyl)methyl]indole-2,3-dione
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methyl 2-(2,6-dichlorophenyl)-4-fluorobenzoate
CID 119013650
1-(2,6-dichlorophenyl)-2,3,5-trifluorobenzene
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Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-fluorofluoren-9-one?
The IUPAC name of 5-chloro-2-fluorofluoren-9-one (CID 82579497) is 5-chloro-2-fluorofluoren-9-one.
What is the SMILES notation for 5-chloro-2-fluorofluoren-9-one?
The canonical SMILES for 5-chloro-2-fluorofluoren-9-one is O=C1c2cc(F)ccc2-c2c(Cl)cccc21.
What is the InChIKey of 5-chloro-2-fluorofluoren-9-one?
The InChIKey is VXVUBINSTHTUJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H6ClFO/c14-11-3-1-2-9-12(11)8-5-4-7(15)6-10(8)13(9)16/h1-6H.
What are the key properties of 5-chloro-2-fluorofluoren-9-one?
5-chloro-2-fluorofluoren-9-one has a molecular weight of 232.64 g/mol, XLogP of 3.69, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-fluorofluoren-9-one is sourced from PubChem (CID 82579497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).