1-benzofuran-2-yl-(4-chlorophenyl)methanone

C15H9ClO2 — CID 838778

IUPAC1-benzofuran-2-yl-(4-chlorophenyl)methanone
SMILESO=C(c1ccc(Cl)cc1)c1cc2ccccc2o1
InChIInChI=1S/C15H9ClO2/c16-12-7-5-10(6-8-12)15(17)14-9-11-3-1-2-4-13(11)18-14/h1-9H
InChIKeyFQHJAAOLWZILJU-UHFFFAOYSA-N
MW256.69 g/mol
LogP4.32
Rot. Bonds2

About 1-benzofuran-2-yl-(4-chlorophenyl)methanone

1-benzofuran-2-yl-(4-chlorophenyl)methanone (PubChem CID 838778) has the molecular formula C15H9ClO2 and a molecular weight of 256.69 g/mol. Its IUPAC name is 1-benzofuran-2-yl-(4-chlorophenyl)methanone.

Molecular Properties

Compound Name1-benzofuran-2-yl-(4-chlorophenyl)methanone
PubChem CID838778
Molecular FormulaC15H9ClO2
Molecular Weight256.69 g/mol
Exact Mass256.03
IUPAC Name1-benzofuran-2-yl-(4-chlorophenyl)methanone
SMILESO=C(c1ccc(Cl)cc1)c1cc2ccccc2o1
InChIInChI=1S/C15H9ClO2/c16-12-7-5-10(6-8-12)15(17)14-9-11-3-1-2-4-13(11)18-14/h1-9H
InChIKeyFQHJAAOLWZILJU-UHFFFAOYSA-N
XLogP4.32
TPSA30.21 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.69
LogP ≤ 54.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-benzofuran-2-yl-(4-chlorophenyl)methanone?
The IUPAC name of 1-benzofuran-2-yl-(4-chlorophenyl)methanone (CID 838778) is 1-benzofuran-2-yl-(4-chlorophenyl)methanone.
What is the SMILES notation for 1-benzofuran-2-yl-(4-chlorophenyl)methanone?
The canonical SMILES for 1-benzofuran-2-yl-(4-chlorophenyl)methanone is O=C(c1ccc(Cl)cc1)c1cc2ccccc2o1.
What is the InChIKey of 1-benzofuran-2-yl-(4-chlorophenyl)methanone?
The InChIKey is FQHJAAOLWZILJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9ClO2/c16-12-7-5-10(6-8-12)15(17)14-9-11-3-1-2-4-13(11)18-14/h1-9H.
What are the key properties of 1-benzofuran-2-yl-(4-chlorophenyl)methanone?
1-benzofuran-2-yl-(4-chlorophenyl)methanone has a molecular weight of 256.69 g/mol, XLogP of 4.32, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzofuran-2-yl-(4-chlorophenyl)methanone is sourced from PubChem (CID 838778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).