8-chloro-2-(5-fluoro-2-hydroxyphenyl)chromen-4-one

C15H8ClFO3 — CID 146460334

IUPAC8-chloro-2-(5-fluoro-2-hydroxyphenyl)chromen-4-one
SMILESO=c1cc(-c2cc(F)ccc2O)oc2c(Cl)cccc12
InChIInChI=1S/C15H8ClFO3/c16-11-3-1-2-9-13(19)7-14(20-15(9)11)10-6-8(17)4-5-12(10)18/h1-7,18H
InChIKeyCHGBFQDFUYZULP-UHFFFAOYSA-N
MW290.68 g/mol
LogP3.96
Rot. Bonds1

About 8-chloro-2-(5-fluoro-2-hydroxyphenyl)chromen-4-one

8-chloro-2-(5-fluoro-2-hydroxyphenyl)chromen-4-one (PubChem CID 146460334) has the molecular formula C15H8ClFO3 and a molecular weight of 290.68 g/mol. Its IUPAC name is 8-chloro-2-(5-fluoro-2-hydroxyphenyl)chromen-4-one.

Molecular Properties

Compound Name8-chloro-2-(5-fluoro-2-hydroxyphenyl)chromen-4-one
PubChem CID146460334
Molecular FormulaC15H8ClFO3
Molecular Weight290.68 g/mol
Exact Mass290.01
IUPAC Name8-chloro-2-(5-fluoro-2-hydroxyphenyl)chromen-4-one
SMILESO=c1cc(-c2cc(F)ccc2O)oc2c(Cl)cccc12
InChIInChI=1S/C15H8ClFO3/c16-11-3-1-2-9-13(19)7-14(20-15(9)11)10-6-8(17)4-5-12(10)18/h1-7,18H
InChIKeyCHGBFQDFUYZULP-UHFFFAOYSA-N
XLogP3.96
TPSA50.44 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.68
LogP ≤ 53.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 8-chloro-2-(5-fluoro-2-hydroxyphenyl)chromen-4-one?
The IUPAC name of 8-chloro-2-(5-fluoro-2-hydroxyphenyl)chromen-4-one (CID 146460334) is 8-chloro-2-(5-fluoro-2-hydroxyphenyl)chromen-4-one.
What is the SMILES notation for 8-chloro-2-(5-fluoro-2-hydroxyphenyl)chromen-4-one?
The canonical SMILES for 8-chloro-2-(5-fluoro-2-hydroxyphenyl)chromen-4-one is O=c1cc(-c2cc(F)ccc2O)oc2c(Cl)cccc12.
What is the InChIKey of 8-chloro-2-(5-fluoro-2-hydroxyphenyl)chromen-4-one?
The InChIKey is CHGBFQDFUYZULP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H8ClFO3/c16-11-3-1-2-9-13(19)7-14(20-15(9)11)10-6-8(17)4-5-12(10)18/h1-7,18H.
What are the key properties of 8-chloro-2-(5-fluoro-2-hydroxyphenyl)chromen-4-one?
8-chloro-2-(5-fluoro-2-hydroxyphenyl)chromen-4-one has a molecular weight of 290.68 g/mol, XLogP of 3.96, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-chloro-2-(5-fluoro-2-hydroxyphenyl)chromen-4-one is sourced from PubChem (CID 146460334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).