2-(2-chlorophenyl)-3-hydroxychromen-4-one

C15H9ClO3 — CID 4915039

IUPAC2-(2-chlorophenyl)-3-hydroxychromen-4-one
SMILESO=c1c(O)c(-c2ccccc2Cl)oc2ccccc12
InChIInChI=1S/C15H9ClO3/c16-11-7-3-1-5-9(11)15-14(18)13(17)10-6-2-4-8-12(10)19-15/h1-8,18H
InChIKeyJDEURDYJJIGSJA-UHFFFAOYSA-N
MW272.69 g/mol
LogP3.82
Rot. Bonds1

About 2-(2-chlorophenyl)-3-hydroxychromen-4-one

2-(2-chlorophenyl)-3-hydroxychromen-4-one (PubChem CID 4915039) has the molecular formula C15H9ClO3 and a molecular weight of 272.69 g/mol. Its IUPAC name is 2-(2-chlorophenyl)-3-hydroxychromen-4-one.

Molecular Properties

Compound Name2-(2-chlorophenyl)-3-hydroxychromen-4-one
PubChem CID4915039
Molecular FormulaC15H9ClO3
Molecular Weight272.69 g/mol
Exact Mass272.02
IUPAC Name2-(2-chlorophenyl)-3-hydroxychromen-4-one
SMILESO=c1c(O)c(-c2ccccc2Cl)oc2ccccc12
InChIInChI=1S/C15H9ClO3/c16-11-7-3-1-5-9(11)15-14(18)13(17)10-6-2-4-8-12(10)19-15/h1-8,18H
InChIKeyJDEURDYJJIGSJA-UHFFFAOYSA-N
XLogP3.82
TPSA50.44 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.69
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenyl)-3-hydroxychromen-4-one?
The IUPAC name of 2-(2-chlorophenyl)-3-hydroxychromen-4-one (CID 4915039) is 2-(2-chlorophenyl)-3-hydroxychromen-4-one.
What is the SMILES notation for 2-(2-chlorophenyl)-3-hydroxychromen-4-one?
The canonical SMILES for 2-(2-chlorophenyl)-3-hydroxychromen-4-one is O=c1c(O)c(-c2ccccc2Cl)oc2ccccc12.
What is the InChIKey of 2-(2-chlorophenyl)-3-hydroxychromen-4-one?
The InChIKey is JDEURDYJJIGSJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9ClO3/c16-11-7-3-1-5-9(11)15-14(18)13(17)10-6-2-4-8-12(10)19-15/h1-8,18H.
What are the key properties of 2-(2-chlorophenyl)-3-hydroxychromen-4-one?
2-(2-chlorophenyl)-3-hydroxychromen-4-one has a molecular weight of 272.69 g/mol, XLogP of 3.82, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenyl)-3-hydroxychromen-4-one is sourced from PubChem (CID 4915039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).