1-(1-benzofuran-2-yl)-2-(2,3-dichlorophenyl)ethanone

C16H10Cl2O2 — CID 107307868

IUPAC1-(1-benzofuran-2-yl)-2-(2,3-dichlorophenyl)ethanone
SMILESO=C(Cc1cccc(Cl)c1Cl)c1cc2ccccc2o1
InChIInChI=1S/C16H10Cl2O2/c17-12-6-3-5-11(16(12)18)8-13(19)15-9-10-4-1-2-7-14(10)20-15/h1-7,9H,8H2
InChIKeyPKQFOIYQSYSRII-UHFFFAOYSA-N
MW305.16 g/mol
LogP5.16
Rot. Bonds3

About 1-(1-benzofuran-2-yl)-2-(2,3-dichlorophenyl)ethanone

1-(1-benzofuran-2-yl)-2-(2,3-dichlorophenyl)ethanone (PubChem CID 107307868) has the molecular formula C16H10Cl2O2 and a molecular weight of 305.16 g/mol. Its IUPAC name is 1-(1-benzofuran-2-yl)-2-(2,3-dichlorophenyl)ethanone.

Molecular Properties

Compound Name1-(1-benzofuran-2-yl)-2-(2,3-dichlorophenyl)ethanone
PubChem CID107307868
Molecular FormulaC16H10Cl2O2
Molecular Weight305.16 g/mol
Exact Mass304.01
IUPAC Name1-(1-benzofuran-2-yl)-2-(2,3-dichlorophenyl)ethanone
SMILESO=C(Cc1cccc(Cl)c1Cl)c1cc2ccccc2o1
InChIInChI=1S/C16H10Cl2O2/c17-12-6-3-5-11(16(12)18)8-13(19)15-9-10-4-1-2-7-14(10)20-15/h1-7,9H,8H2
InChIKeyPKQFOIYQSYSRII-UHFFFAOYSA-N
XLogP5.16
TPSA30.21 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500305.16
LogP ≤ 55.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(1-benzofuran-2-yl)-2-(3-chlorophenyl)ethanone
CID 55083649
1-(1-benzofuran-2-yl)-2-(2-chloro-4-fluorophenyl)ethanone
CID 63091479
1-(1-benzofuran-2-yl)-2-(2-chlorophenoxy)ethanone
CID 7816108
3-amino-1-(1-benzofuran-2-yl)propan-1-one
CID 82275110
1-(1-benzofuran-2-yl)-2-(3-chlorophenyl)sulfanylethanone
CID 62646826
1-(1-benzofuran-2-yl)-2-(3,4-dichloroanilino)ethanone
CID 110824293
1-(1-benzofuran-2-yl)-3,3-dimethylbutan-1-one
CID 114725277
1-(1-benzofuran-2-yl)-2-(3,5-dichlorophenoxy)ethanone
CID 60623980
1-(4-aminophenyl)-2-(2,3-dichlorophenyl)ethanone
CID 107308085
1-(1-benzofuran-2-yl)-2-(methylamino)ethanone;ethane
CID 171632781
1-(1-benzofuran-2-yl)pentane-1,3-dione
CID 28896262
3-[4-[(2,3-dichlorophenyl)methyl]piperazine-1-carbonyl]chromen-2-one
CID 86903574

Frequently Asked Questions

What is the IUPAC name of 1-(1-benzofuran-2-yl)-2-(2,3-dichlorophenyl)ethanone?
The IUPAC name of 1-(1-benzofuran-2-yl)-2-(2,3-dichlorophenyl)ethanone (CID 107307868) is 1-(1-benzofuran-2-yl)-2-(2,3-dichlorophenyl)ethanone.
What is the SMILES notation for 1-(1-benzofuran-2-yl)-2-(2,3-dichlorophenyl)ethanone?
The canonical SMILES for 1-(1-benzofuran-2-yl)-2-(2,3-dichlorophenyl)ethanone is O=C(Cc1cccc(Cl)c1Cl)c1cc2ccccc2o1.
What is the InChIKey of 1-(1-benzofuran-2-yl)-2-(2,3-dichlorophenyl)ethanone?
The InChIKey is PKQFOIYQSYSRII-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10Cl2O2/c17-12-6-3-5-11(16(12)18)8-13(19)15-9-10-4-1-2-7-14(10)20-15/h1-7,9H,8H2.
What are the key properties of 1-(1-benzofuran-2-yl)-2-(2,3-dichlorophenyl)ethanone?
1-(1-benzofuran-2-yl)-2-(2,3-dichlorophenyl)ethanone has a molecular weight of 305.16 g/mol, XLogP of 5.16, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-benzofuran-2-yl)-2-(2,3-dichlorophenyl)ethanone is sourced from PubChem (CID 107307868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).