2-(4-bromo-2-fluorophenyl)-1-(furan-2-yl)ethanone

C12H8BrFO2 — CID 62716973

IUPAC2-(4-bromo-2-fluorophenyl)-1-(furan-2-yl)ethanone
SMILESO=C(Cc1ccc(Br)cc1F)c1ccco1
InChIInChI=1S/C12H8BrFO2/c13-9-4-3-8(10(14)7-9)6-11(15)12-2-1-5-16-12/h1-5,7H,6H2
InChIKeyLCXOAIOPXPISNN-UHFFFAOYSA-N
MW283.10 g/mol
LogP3.61
Rot. Bonds3

About 2-(4-bromo-2-fluorophenyl)-1-(furan-2-yl)ethanone

2-(4-bromo-2-fluorophenyl)-1-(furan-2-yl)ethanone (PubChem CID 62716973) has the molecular formula C12H8BrFO2 and a molecular weight of 283.10 g/mol. Its IUPAC name is 2-(4-bromo-2-fluorophenyl)-1-(furan-2-yl)ethanone.

Molecular Properties

Compound Name2-(4-bromo-2-fluorophenyl)-1-(furan-2-yl)ethanone
PubChem CID62716973
Molecular FormulaC12H8BrFO2
Molecular Weight283.10 g/mol
Exact Mass281.97
IUPAC Name2-(4-bromo-2-fluorophenyl)-1-(furan-2-yl)ethanone
SMILESO=C(Cc1ccc(Br)cc1F)c1ccco1
InChIInChI=1S/C12H8BrFO2/c13-9-4-3-8(10(14)7-9)6-11(15)12-2-1-5-16-12/h1-5,7H,6H2
InChIKeyLCXOAIOPXPISNN-UHFFFAOYSA-N
XLogP3.61
TPSA30.21 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.10
LogP ≤ 53.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-bromo-2-fluorophenyl)-3-(furan-2-yl)propane-1,3-dione
CID 82966938
2-(5-chloro-2-fluorophenyl)-1-(furan-2-yl)ethanone
CID 103047974
1,2-bis(4-bromo-2-fluorophenyl)ethanone
CID 114905955
3-[5-[3-(4-bromo-2-fluorophenyl)-2-oxopropyl]sulfanyl-4-ethyl-1,2,4-triazol-3-yl]-1-(furan-2-yl)propan-1-one
CID 158627813
2-(4-bromo-2-fluorophenyl)acetyl iodide
CID 90435604
2-(4-bromo-2-fluorophenyl)-1-(furan-2-yl)ethanol
CID 62715953
2-(4-bromo-2-fluorophenyl)-1-(2-methylphenyl)ethanone
CID 55096453
2-(4-bromo-2-fluorophenyl)-1-(4-chloro-2-fluorophenyl)ethanone
CID 63081571
2-(4-bromo-2-fluorophenyl)-1-(2,4,6-trimethylphenyl)ethanone
CID 114968519
2-(4-bromo-2-fluorophenyl)-1-(2,3-dichlorophenyl)ethanone
CID 114968448
2-(4-bromo-2-fluorophenyl)-1-(3-bromo-2-methylphenyl)ethanone
CID 114968520
2-(4-chlorophenyl)-1-(furan-2-yl)ethanone
CID 11096153

Frequently Asked Questions

What is the IUPAC name of 2-(4-bromo-2-fluorophenyl)-1-(furan-2-yl)ethanone?
The IUPAC name of 2-(4-bromo-2-fluorophenyl)-1-(furan-2-yl)ethanone (CID 62716973) is 2-(4-bromo-2-fluorophenyl)-1-(furan-2-yl)ethanone.
What is the SMILES notation for 2-(4-bromo-2-fluorophenyl)-1-(furan-2-yl)ethanone?
The canonical SMILES for 2-(4-bromo-2-fluorophenyl)-1-(furan-2-yl)ethanone is O=C(Cc1ccc(Br)cc1F)c1ccco1.
What is the InChIKey of 2-(4-bromo-2-fluorophenyl)-1-(furan-2-yl)ethanone?
The InChIKey is LCXOAIOPXPISNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8BrFO2/c13-9-4-3-8(10(14)7-9)6-11(15)12-2-1-5-16-12/h1-5,7H,6H2.
What are the key properties of 2-(4-bromo-2-fluorophenyl)-1-(furan-2-yl)ethanone?
2-(4-bromo-2-fluorophenyl)-1-(furan-2-yl)ethanone has a molecular weight of 283.10 g/mol, XLogP of 3.61, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromo-2-fluorophenyl)-1-(furan-2-yl)ethanone is sourced from PubChem (CID 62716973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).