2-(4-chlorophenyl)-1-(2,3-dihydrofuran-5-yl)ethanone

C12H11ClO2 — CID 102650858

IUPAC2-(4-chlorophenyl)-1-(2,3-dihydrofuran-5-yl)ethanone
SMILESO=C(Cc1ccc(Cl)cc1)C1=CCCO1
InChIInChI=1S/C12H11ClO2/c13-10-5-3-9(4-6-10)8-11(14)12-2-1-7-15-12/h2-6H,1,7-8H2
InChIKeyNMXHBJPWXFRXDB-UHFFFAOYSA-N
MW222.67 g/mol
LogP2.76
Rot. Bonds3

About 2-(4-chlorophenyl)-1-(2,3-dihydrofuran-5-yl)ethanone

2-(4-chlorophenyl)-1-(2,3-dihydrofuran-5-yl)ethanone (PubChem CID 102650858) has the molecular formula C12H11ClO2 and a molecular weight of 222.67 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-1-(2,3-dihydrofuran-5-yl)ethanone.

Molecular Properties

Compound Name2-(4-chlorophenyl)-1-(2,3-dihydrofuran-5-yl)ethanone
PubChem CID102650858
Molecular FormulaC12H11ClO2
Molecular Weight222.67 g/mol
Exact Mass222.04
IUPAC Name2-(4-chlorophenyl)-1-(2,3-dihydrofuran-5-yl)ethanone
SMILESO=C(Cc1ccc(Cl)cc1)C1=CCCO1
InChIInChI=1S/C12H11ClO2/c13-10-5-3-9(4-6-10)8-11(14)12-2-1-7-15-12/h2-6H,1,7-8H2
InChIKeyNMXHBJPWXFRXDB-UHFFFAOYSA-N
XLogP2.76
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.67
LogP ≤ 52.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2,3-dihydrofuran-5-yl)-2-(3,4-dimethylphenyl)ethanone
CID 102650916
1-(6-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-2-(4-chlorophenyl)ethanone
CID 43340567
1,3-bis(4-chlorophenyl)propan-2-one
CID 11097890
2-(4-chlorophenyl)-1-(2,3-dihydro-1,4-benzodioxin-5-yl)ethanone
CID 61078419
2-(4-chlorophenyl)-1-(2,4,5-trifluorophenyl)ethanone
CID 103301488
2-(4-chlorophenyl)-1-(furan-2-yl)ethanone
CID 11096153
2-(4-chlorophenyl)acetate
CID 5460378
3-[2-(4-chlorophenyl)acetyl]-1,3-oxazolidin-2-one
CID 102525452
1-(2-chlorofuran-3-yl)-2-(4-chlorophenyl)ethanone
CID 106687672
2-(4-chlorophenyl)-1-(3,4-dihydro-2H-chromen-6-yl)ethanone
CID 61027612
[(3R)-2-oxooxolan-3-yl] 2-(4-chlorophenyl)acetate
CID 8896967
2-(4-chlorophenyl)acetyl iodide
CID 89264950

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-1-(2,3-dihydrofuran-5-yl)ethanone?
The IUPAC name of 2-(4-chlorophenyl)-1-(2,3-dihydrofuran-5-yl)ethanone (CID 102650858) is 2-(4-chlorophenyl)-1-(2,3-dihydrofuran-5-yl)ethanone.
What is the SMILES notation for 2-(4-chlorophenyl)-1-(2,3-dihydrofuran-5-yl)ethanone?
The canonical SMILES for 2-(4-chlorophenyl)-1-(2,3-dihydrofuran-5-yl)ethanone is O=C(Cc1ccc(Cl)cc1)C1=CCCO1.
What is the InChIKey of 2-(4-chlorophenyl)-1-(2,3-dihydrofuran-5-yl)ethanone?
The InChIKey is NMXHBJPWXFRXDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11ClO2/c13-10-5-3-9(4-6-10)8-11(14)12-2-1-7-15-12/h2-6H,1,7-8H2.
What are the key properties of 2-(4-chlorophenyl)-1-(2,3-dihydrofuran-5-yl)ethanone?
2-(4-chlorophenyl)-1-(2,3-dihydrofuran-5-yl)ethanone has a molecular weight of 222.67 g/mol, XLogP of 2.76, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-1-(2,3-dihydrofuran-5-yl)ethanone is sourced from PubChem (CID 102650858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).